N-(2,3-dihydro-1H-inden-5-yl)-3-(2,5-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-(2,5-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-(2,3-dihydro-1H-inden-5-yl)-3-(2,5-dimethoxyphenyl)-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061481 |
| Compound Name: | N-(2,3-dihydro-1H-inden-5-yl)-3-(2,5-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(c(c1)N1C(c2ccc(cc2NC1=S)C(Nc1ccc2CCCc2c1)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.8244 |
| logD: | 4.8171 |
| logSw: | -4.5272 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.957 |
| InChI Key: | PZGUMBVWTNKLFA-UHFFFAOYSA-N |