Account RUNX-IN-1
- Catalog No. :
- ACOCFY491
- CAS No. :
- 2177285-35-5
- Molecular Formula :
- C71H88Cl2N24O11
- Molecular Weight :
- 1524.55
IUPAC Name:4-(3-(4-(4-(bis(2-chloroethyl)amino)phenyl)butanamido)propanamido)-N-(5-((2-((2-((4-((5-((5-((5-((5-((3-(dimethylamino)propyl)carbamoyl)-1-methyl-1H-pyrrol-3-yl)carbamoyl)-1-methyl-1H-pyrrol-3-yl)carbamoyl)-1-methyl-1H-pyrrol-3-yl)carbamoyl)-1-methyl-1H-pyrrol-3-yl)amino)-4-oxobutyl)carbamoyl)-1-methyl-1H-imidazol-4-yl)carbamoyl)-1-methyl-1H-imidazol-4-yl)carbamoyl)-1-methyl-1H-pyrrol-3-yl)-1-methyl-1H-imidazole-2-carboxamide
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Product Information
| Product Name | RUNX-IN-1 |
|---|---|
| IUPAC Name | 4-(3-(4-(4-(bis(2-chloroethyl)amino)phenyl)butanamido)propanamido)-N-(5-((2-((2-((4-((5-((5-((5-((5-((3-(dimethylamino)propyl)carbamoyl)-1-methyl-1H-pyrrol-3-yl)carbamoyl)-1-methyl-1H-pyrrol-3-yl)carbamoyl)-1-methyl-1H-pyrrol-3-yl)carbamoyl)-1-methyl-1H-pyrrol-3-yl)amino)-4-oxobutyl)carbamoyl)-1-methyl-1H-imidazol-4-yl)carbamoyl)-1-methyl-1H-imidazol-4-yl)carbamoyl)-1-methyl-1H-pyrrol-3-yl)-1-methyl-1H-imidazole-2-carboxamide |
| Molecular Formula | C71H88Cl2N24O11 |
| Molecular Weight | 1524.55 |
| SMILES | O=C(NC=1N=C(C(=O)NCCCC(=O)NC=2C=C(C(=O)NC=3C=C(C(=O)NC=4C=C(C(=O)NC=5C=C(C(=O)NCCCN(C)C)N(C5)C)N(C4)C)N(C3)C)N(C2)C)N(C1)C)C6=NC(=CN6C)NC(=O)C7=CC(=CN7C)NC(=O)C8=NC(=CN8C)NC(=O)CCNC(=O)CCCC9=CC=C(C=C9)N(CCCl)CCCl |
| InChI Key | KEMUNUGWVPYFER-UHFFFAOYSA-N |
| Synonym | 1H-Imidazole-2-carboxamide, 4-[[[4-[[[4-[[3-[[4-[4-[bis(2-chloroethyl)amino]phenyl]-1-oxobutyl]amino]-1-oxopropyl]amino]-1-methyl-1H-imidazol-2-yl]carbonyl]amino]-1-methyl-1H-pyrrol-2-yl]carbonyl]amino]-N-[2-[[[4-[[5-[[[5-[[[5-[[[5-[[[3-(dimethylamino)propyl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]amino]-4-oxobutyl]amino]carbonyl]-1-methyl-1H-imidazol-4-yl]-1-methyl-;1H-Imidazole-2-carboxamide, 4-[[[4-[[[4-[[3-[[4-[4-[bis(2-chloroethyl)amino]phenyl]-1-oxobutyl]amino]-1-oxopropyl]amino]-1-methyl-1H-imidazol-2-yl]carbonyl]amino]-1-methyl-1H-pyrrol-2-yl]carbonyl]amino]-N-[2-[[[4-[[5-[[[5-[[[5-[[[5-[[[3-(dimethylamino)propyl]amino]carbonyl]-1-methyl-1H-pyrrol-3-yl]a...;RUNX-IN-1 |
| CAS No. | 2177285-35-5 |
Synthetic Route by SureRoute
2. ACOCFY491 Molecular Building Block Synthetic Route
RUNX-IN-2
N-(3-Amino-3-iminopropyl)-4-(4-(2-guanidinoacetamido)-1-methyl-1H-pyrrole-2-carboxamido)-1-methyl-1H-imidazole-2-carboxamide sulfate
4-(4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-1-methyl-1H-pyrrole-2-carboxamido)-1-methyl-1H-imidazole-2-carboxylic acid