N-(3-chloro-4-methylphenyl)-2-[(4-oxo-3-phenyl-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-[(4-oxo-3-phenyl-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide
N-(3-chloro-4-methylphenyl)-2-[(4-oxo-3-phenyl-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | G856-0871 |
| Compound Name: | N-(3-chloro-4-methylphenyl)-2-[(4-oxo-3-phenyl-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 474.97 |
| Molecular Formula: | C25 H19 Cl N4 O2 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CSC1=Nc2c3ccccc3[nH]c2C(N1c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3166 |
| logD: | 5.3165 |
| logSw: | -5.9547 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.267 |
| InChI Key: | WNLJDYFAWYBWCT-UHFFFAOYSA-N |