N-[(4-chlorophenyl)methyl]-5,6-dimethyl-7-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-5,6-dimethyl-7-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide
N-[(4-chlorophenyl)methyl]-5,6-dimethyl-7-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | L555-0481 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-5,6-dimethyl-7-phenyl-4-(piperidin-1-yl)-7H-pyrrolo[2,3-d]pyrimidine-2-carboxamide |
| Molecular Weight: | 474.01 |
| Molecular Formula: | C27 H28 Cl N5 O |
| Smiles: | Cc1c2c(nc(C(NCc3ccc(cc3)[Cl])=O)nc2n(c2ccccc2)c1C)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 6.0205 |
| logD: | 6.0204 |
| logSw: | -6.0604 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.411 |
| InChI Key: | UBBBSOXNRXKJFK-UHFFFAOYSA-N |