N-cyclopentyl-4-({2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)benzamide
Chemical Structure Depiction of
N-cyclopentyl-4-({2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)benzamide
N-cyclopentyl-4-({2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)benzamide
Compound characteristics
| Compound ID: | G629-0180 |
| Compound Name: | N-cyclopentyl-4-({2-[(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)benzamide |
| Molecular Weight: | 540.68 |
| Molecular Formula: | C31 H32 N4 O3 S |
| Smiles: | Cc1ccc(CNC(CSC2=Nc3ccccc3C(N2Cc2ccc(cc2)C(NC2CCCC2)=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6445 |
| logD: | 4.6445 |
| logSw: | -4.3868 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.747 |
| InChI Key: | BLXBWWPDEGNOBJ-UHFFFAOYSA-N |