ethyl 4-(3-benzyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carbonyl)piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-(3-benzyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carbonyl)piperazine-1-carboxylate
ethyl 4-(3-benzyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carbonyl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | A0015823 |
| Compound Name: | ethyl 4-(3-benzyl-2-{[(3-chlorophenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carbonyl)piperazine-1-carboxylate |
| Molecular Weight: | 577.1 |
| Molecular Formula: | C30 H29 Cl N4 O4 S |
| Smiles: | CCOC(N1CCN(CC1)C(c1ccc2C(N(Cc3ccccc3)C(=Nc2c1)SCc1cccc(c1)[Cl])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1098 |
| logD: | 5.1098 |
| logSw: | -5.2776 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.199 |
| InChI Key: | YJROEBGATAUKDZ-UHFFFAOYSA-N |