Account tert-Butyl ((63S,4S)-10,10-dimethyl-5,7-dioxo-12-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-61,62,63,64,65,66-hexahydro-11H-8-oxa-2(4,2)-thiazola-1(5,3)-indola-6(1,3)-pyridazinacycloundecaphane-4-yl)carbamate
- Catalog No. :
- ACBGNZ860
- CAS No. :
- 2764998-33-4
- Molecular Formula :
- C35H48BN5O7S
- Molecular Weight :
- 693.68
IUPAC Name:tert-butyl ((63S,4S,Z)-10,10-dimethyl-5,7-dioxo-12-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-61,62,63,64,65,66-hexahydro-11H-8-oxa-2(4,2)-thiazola-1(5,3)-indola-6(1,3)-pyridazinacycloundecaphane-4-yl)carbamate
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Product Information
| Product Name | tert-Butyl ((63S,4S)-10,10-dimethyl-5,7-dioxo-12-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-61,62,63,64,65,66-hexahydro-11H-8-oxa-2(4,2)-thiazola-1(5,3)-indola-6(1,3)-pyridazinacycloundecaphane-4-yl)carbamate |
|---|---|
| IUPAC Name | tert-butyl ((63S,4S,Z)-10,10-dimethyl-5,7-dioxo-12-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-61,62,63,64,65,66-hexahydro-11H-8-oxa-2(4,2)-thiazola-1(5,3)-indola-6(1,3)-pyridazinacycloundecaphane-4-yl)carbamate |
| Molecular Formula | C35H48BN5O7S |
| Molecular Weight | 693.68 |
| SMILES | CC1(C)CC2=C(NC=3C2=CC(=CC3)C=4N=C(SC4)C[C@H](NC(OC(C)(C)C)=O)C(=O)N5N[C@](C(=O)OC1)(CCC5)[H])B6OC(C)(C)C(C)(C)O6 |
| InChI Key | XDVHITWPQPDPIG-DQEYMECFSA-N |
| Synonym | tert-butyl N-[(7S,13S)-17,17-dimethyl-8,14-dioxo-20-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-15-oxa-4-thia-9,21,27,28-tetraazapentacyclo[17.5.2.12,?.1?,13.022,2?]octacosa-1(24),2,5(28),19,22,25-hexaen-7-yl]carbamate;tert-butyl ((6(3)S,4S,Z)-10,10-dimethyl-5,7-dioxo-1(2)-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6(1),6(2),6(3),6(4),6(5),6(6)-hexahydro-1(1)H-8-oxa-2(4,2)-thiazola-1(5,3)-indola-6(1,3)-pyridazinacycloundecaphane-4-yl)carbamate;pan Kras-int;Carbamic acid, N-[(14S,18S)-18,19,20,21-tetrahydro-25,25-dimethyl-15,22-dioxo-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-17H-5,3-([4,2]-endo-thiazolopropano[1,3]-endo-pyridazinomethanoxypropano)-1H-indol-14-yl]-, 1,1-dimethylethyl ester;tert-Butyl ((63S,4S)-10,10-dimethyl-5,7-dioxo-12-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-61,62,63,64,65,66-hexahydro-11H-8-oxa-2(4,2)-thiazola-1(5,3)-indola-6(1,3)-pyridazinacycloundecaphane-4-yl)carbamate;tert-butyl ((6(3)S,4S,Z)-10,10-dimethyl-5,7-dioxo-1(2)-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6(1),6(2),6(3),6(4),6(5),6(6)-hexahydro-1(1)H-8-oxa-2(4,2)-thiazola-1(5,3)-indola-6(1,3)-pyridazina |
| CAS No. | 2764998-33-4 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACBGNZ860 Molecular Building Block Synthetic Route
(1r,2R,3S)-N-((63S,4S,Z)-10,10-dimethyl-5,7-dioxo-12-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-61,62,63,64,65,66-hexahydro-11H-8-oxa-2(4,2)-thiazola-1(5,3)-indola-6(1,3)-pyridazinacycloundecaphane-4-yl)-2,3-dimethylcyclopropane-1-carboxamide
tert-Butyl ((63S,4S)-25-(benzyloxy)-10,10-dimethyl-5,7-dioxo-12-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-61,62,63,64,65,66-hexahydro-11H-8-oxa-1(5,3)-indola-6(1,3)-pyridazina-2(1,3)-benzenacycloundecaphane-4-yl)carbamate
tert-Butyl ((63S,4S)-12-iodo-10,10-dimethyl-5,7-dioxo-61,62,63,64,65,66-hexahydro-11H-8-oxa-2(4,2)-thiazola-1(5,3)-indola-6(1,3)-pyridazinacycloundecaphane-4-yl)carbamate