N-(3,8-dimethyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-2-yl)-N'-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)urea
Chemical Structure Depiction of
N-(3,8-dimethyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-2-yl)-N'-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)urea
N-(3,8-dimethyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-2-yl)-N'-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)urea
Compound characteristics
| Compound ID: | C791-0580 |
| Compound Name: | N-(3,8-dimethyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepin-2-yl)-N'-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)urea |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C17 H19 N5 O3 S2 |
| Smiles: | CC1CCC2=Nc3c(C(N2CC1)=O)c(C)c(NC(NC1=NC(CS1)=O)=O)s3 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8175 |
| logD: | 1.7599 |
| logSw: | -2.4947 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.389 |
| InChI Key: | DQLBWPLLBLVFCF-MRVPVSSYSA-N |