N,N-diethyl-2-[(6-ethyl-6,11-dimethyl-7-oxo-5,6,7,11-tetrahydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-9-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N,N-diethyl-2-[(6-ethyl-6,11-dimethyl-7-oxo-5,6,7,11-tetrahydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-9-yl)sulfanyl]acetamide
N,N-diethyl-2-[(6-ethyl-6,11-dimethyl-7-oxo-5,6,7,11-tetrahydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-9-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D461-0198 |
| Compound Name: | N,N-diethyl-2-[(6-ethyl-6,11-dimethyl-7-oxo-5,6,7,11-tetrahydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-9-yl)sulfanyl]acetamide |
| Molecular Weight: | 439.58 |
| Molecular Formula: | C23 H29 N5 O2 S |
| Smiles: | CCC1(C)Cc2ccccc2C2=C1C(N1C(=N2)N(C)N=C1SCC(N(CC)CC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4594 |
| logD: | 3.4571 |
| logSw: | -3.6039 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.924 |
| InChI Key: | AZQORQPZCJDNCU-QHCPKHFHSA-N |