3-[(4-chlorophenyl)methyl]-N-[2-(morpholin-4-yl)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-[(4-chlorophenyl)methyl]-N-[2-(morpholin-4-yl)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-[(4-chlorophenyl)methyl]-N-[2-(morpholin-4-yl)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K288-0705 |
| Compound Name: | 3-[(4-chlorophenyl)methyl]-N-[2-(morpholin-4-yl)ethyl]-4-oxo-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 458.97 |
| Molecular Formula: | C22 H23 Cl N4 O3 S |
| Smiles: | C(CN1CCOCC1)NC(c1ccc2C(N(Cc3ccc(cc3)[Cl])C(Nc2c1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7429 |
| logD: | 2.728 |
| logSw: | -3.7794 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.464 |
| InChI Key: | TUIFEJDDXZHZAF-UHFFFAOYSA-N |