N-(adamantan-1-yl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-(adamantan-1-yl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
N-(adamantan-1-yl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | V027-5892 |
| Compound Name: | N-(adamantan-1-yl)-4-(2-ethyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxamide |
| Molecular Weight: | 479.69 |
| Molecular Formula: | C27 H37 N5 O S |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c3CCCCc3sc2n1)N1CCN(CC1)C(NC12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3369 |
| logD: | 5.9073 |
| logSw: | -5.646 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.506 |
| InChI Key: | LSRRTLNCTAYWSC-UHFFFAOYSA-N |