4-{[2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclohexylbenzamide
Chemical Structure Depiction of
4-{[2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclohexylbenzamide
4-{[2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclohexylbenzamide
Compound characteristics
| Compound ID: | K284-7261 |
| Compound Name: | 4-{[2-{[2-(butylamino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]methyl}-N-cyclohexylbenzamide |
| Molecular Weight: | 506.67 |
| Molecular Formula: | C28 H34 N4 O3 S |
| Smiles: | CCCCNC(CSC1=Nc2ccccc2C(N1Cc1ccc(cc1)C(NC1CCCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3302 |
| logD: | 4.3302 |
| logSw: | -4.2974 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.494 |
| InChI Key: | JWNCQOPYQZXJIS-UHFFFAOYSA-N |