N-cyclohexyl-3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-cyclohexyl-3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-cyclohexyl-3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061199 |
| Compound Name: | N-cyclohexyl-3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C22 H23 N3 O3 S |
| Smiles: | COc1ccc(cc1)N1C(c2ccc(cc2NC1=S)C(NC1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7997 |
| logD: | 3.786 |
| logSw: | -4.0593 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.389 |
| InChI Key: | NBQLTXPJQOUBIA-UHFFFAOYSA-N |