N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Chemical Structure Depiction of
N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-(4-oxoquinazolin-3(4H)-yl)butanamide
N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-(4-oxoquinazolin-3(4H)-yl)butanamide
Compound characteristics
| Compound ID: | Y044-4534 |
| Compound Name: | N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-4-(4-oxoquinazolin-3(4H)-yl)butanamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C24 H27 N5 O2 S |
| Smiles: | Cn1c2ccccc2nc1[C@H](CCSC)NC(CCCN1C=Nc2ccccc2C1=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8967 |
| logD: | 1.8928 |
| logSw: | -2.7169 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.429 |
| InChI Key: | GERAOCZJKBYOKV-FQEVSTJZSA-N |