N-cyclopentyl-2-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-(3-methylbutyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-2-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-(3-methylbutyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
N-cyclopentyl-2-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-(3-methylbutyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | F067-1328 |
| Compound Name: | N-cyclopentyl-2-{[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl}-3-(3-methylbutyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 505.68 |
| Molecular Formula: | C29 H35 N3 O3 S |
| Smiles: | CC(C)CCN1C(=Nc2cc(ccc2C1=O)C(NC1CCCC1)=O)SCC(c1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9567 |
| logD: | 5.9567 |
| logSw: | -5.3281 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.772 |
| InChI Key: | XODFWWHJGWRRJA-UHFFFAOYSA-N |