4-({2-[(2-anilino-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-cyclopentylbenzamide
Chemical Structure Depiction of
4-({2-[(2-anilino-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-cyclopentylbenzamide
4-({2-[(2-anilino-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-cyclopentylbenzamide
Compound characteristics
| Compound ID: | G629-0192 |
| Compound Name: | 4-({2-[(2-anilino-2-oxoethyl)sulfanyl]-4-oxoquinazolin-3(4H)-yl}methyl)-N-cyclopentylbenzamide |
| Molecular Weight: | 512.63 |
| Molecular Formula: | C29 H28 N4 O3 S |
| Smiles: | C1CCC(C1)NC(c1ccc(CN2C(=Nc3ccccc3C2=O)SCC(Nc2ccccc2)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3481 |
| logD: | 4.3481 |
| logSw: | -4.4095 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.425 |
| InChI Key: | CXXQHEQCRSYNKM-UHFFFAOYSA-N |