N-(3-chlorophenyl)-2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide
N-(3-chlorophenyl)-2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide
Compound characteristics
| Compound ID: | S529-0301 |
| Compound Name: | N-(3-chlorophenyl)-2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide |
| Molecular Weight: | 370.84 |
| Molecular Formula: | C19 H19 Cl N4 O2 |
| Smiles: | C1Cc2c(cnc(C3CC3)n2)C(N(C1)CC(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.894 |
| logD: | 2.8937 |
| logSw: | -3.6498 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.911 |
| InChI Key: | UYNSXMRXAMAGQJ-UHFFFAOYSA-N |