N-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]thiophene-2-carboxamide
N-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | K284-4820 |
| Compound Name: | N-[2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]thiophene-2-carboxamide |
| Molecular Weight: | 450.54 |
| Molecular Formula: | C22 H18 N4 O3 S2 |
| Smiles: | C(c1ccccc1)NC(CSC1=Nc2ccccc2C(N1NC(c1cccs1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2246 |
| logD: | 2.224 |
| logSw: | -2.9724 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.662 |
| InChI Key: | NDBQMCBNWAXCSO-UHFFFAOYSA-N |