N-(2,3-dihydro-1H-inden-5-yl)-3-(3,4-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1H-inden-5-yl)-3-(3,4-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-(2,3-dihydro-1H-inden-5-yl)-3-(3,4-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061877 |
| Compound Name: | N-(2,3-dihydro-1H-inden-5-yl)-3-(3,4-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 473.55 |
| Molecular Formula: | C26 H23 N3 O4 S |
| Smiles: | COc1ccc(cc1OC)N1C(c2ccc(cc2NC1=S)C(Nc1ccc2CCCc2c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2895 |
| logD: | 4.2605 |
| logSw: | -4.3287 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.345 |
| InChI Key: | ZTOMOOUOAGYKSJ-UHFFFAOYSA-N |