N-(cyclohexylmethyl)-2-(2-methyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide
Chemical Structure Depiction of
N-(cyclohexylmethyl)-2-(2-methyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide
N-(cyclohexylmethyl)-2-(2-methyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide
Compound characteristics
| Compound ID: | S529-0225 |
| Compound Name: | N-(cyclohexylmethyl)-2-(2-methyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide |
| Molecular Weight: | 330.43 |
| Molecular Formula: | C18 H26 N4 O2 |
| Smiles: | Cc1ncc2C(N(CCCc2n1)CC(NCC1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4852 |
| logD: | 1.4852 |
| logSw: | -2.0694 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.787 |
| InChI Key: | MHIBBFNTMVUPDE-UHFFFAOYSA-N |