N-(2,3-dimethylcyclohexyl)-3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-(2,3-dimethylcyclohexyl)-3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-(2,3-dimethylcyclohexyl)-3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K284-3219 |
| Compound Name: | N-(2,3-dimethylcyclohexyl)-3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 417.57 |
| Molecular Formula: | C22 H31 N3 O3 S |
| Smiles: | CCOCCCN1C(c2ccc(cc2NC1=S)C(NC1CCCC(C)C1C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.397 |
| logD: | 3.3943 |
| logSw: | -3.8012 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.074 |
| InChI Key: | VBVOZXRIKNTSEU-UHFFFAOYSA-N |