N-[3-(morpholin-4-yl)propyl]-4-oxo-3-[(oxolan-2-yl)methyl]-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[3-(morpholin-4-yl)propyl]-4-oxo-3-[(oxolan-2-yl)methyl]-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-3,4-dihydroquinazoline-7-carboxamide
N-[3-(morpholin-4-yl)propyl]-4-oxo-3-[(oxolan-2-yl)methyl]-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | K284-4562 |
| Compound Name: | N-[3-(morpholin-4-yl)propyl]-4-oxo-3-[(oxolan-2-yl)methyl]-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 572.71 |
| Molecular Formula: | C26 H32 N6 O5 S2 |
| Smiles: | C(CNC(c1ccc2C(N(CC3CCCO3)C(=Nc2c1)SCC(Nc1nccs1)=O)=O)=O)CN1CCOCC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7876 |
| logD: | 0.3994 |
| logSw: | -2.3804 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.199 |
| InChI Key: | YFJYTQUGTPOIDN-LJQANCHMSA-N |