(4-methyl-3-nitrophenyl)[4-(2-propyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone
Chemical Structure Depiction of
(4-methyl-3-nitrophenyl)[4-(2-propyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone
(4-methyl-3-nitrophenyl)[4-(2-propyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | V030-8988 |
| Compound Name: | (4-methyl-3-nitrophenyl)[4-(2-propyl-6,7,8,9-tetrahydro-5H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 493.63 |
| Molecular Formula: | C26 H31 N5 O3 S |
| Salt: | not_available |
| Smiles: | CCCc1nc(c2c3CCCCCc3sc2n1)N1CCN(CC1)C(c1ccc(C)c(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3284 |
| logD: | 5.8251 |
| logSw: | -5.67 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.079 |
| InChI Key: | XUGOPPCUEAHGIE-UHFFFAOYSA-N |