4-(7-methyl-2-propyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-(7-methyl-2-propyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide
4-(7-methyl-2-propyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V002-5203 |
| Compound Name: | 4-(7-methyl-2-propyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 517.62 |
| Molecular Formula: | C26 H30 F3 N5 O S |
| Salt: | not_available |
| Smiles: | CCCc1nc(c2c3CCC(C)Cc3sc2n1)N1CCN(CC1)C(Nc1ccc(cc1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.2354 |
| logD: | 6.8773 |
| logSw: | -5.9661 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.488 |
| InChI Key: | AOKJYMBUJTWXAV-MRXNPFEDSA-N |