N-(3-methoxyphenyl)-2-({4-oxo-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-methoxyphenyl)-2-({4-oxo-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
N-(3-methoxyphenyl)-2-({4-oxo-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | K284-3057 |
| Compound Name: | N-(3-methoxyphenyl)-2-({4-oxo-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]-3,4-dihydroquinazolin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 571.7 |
| Molecular Formula: | C31 H33 N5 O4 S |
| Smiles: | COc1cccc(c1)NC(CSC1=Nc2ccccc2C(N1CCCC(N1CCN(CC1)c1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4621 |
| logD: | 3.4621 |
| logSw: | -3.9198 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.095 |
| InChI Key: | NVHREHJXQULCMW-UHFFFAOYSA-N |