3-cyclohexyl-N-(3,4-dimethoxyphenyl)-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-cyclohexyl-N-(3,4-dimethoxyphenyl)-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
3-cyclohexyl-N-(3,4-dimethoxyphenyl)-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0016168 |
| Compound Name: | 3-cyclohexyl-N-(3,4-dimethoxyphenyl)-2-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 537.68 |
| Molecular Formula: | C29 H35 N3 O5 S |
| Smiles: | CC(C)(C)C(CSC1=Nc2cc(ccc2C(N1C1CCCCC1)=O)C(Nc1ccc(c(c1)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0506 |
| logD: | 5.0481 |
| logSw: | -4.6842 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.863 |
| InChI Key: | OQJVTESVMNJWON-UHFFFAOYSA-N |