N-[2-(3-methylpiperidin-1-yl)ethyl]-2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide
Chemical Structure Depiction of
N-[2-(3-methylpiperidin-1-yl)ethyl]-2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide
N-[2-(3-methylpiperidin-1-yl)ethyl]-2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide
Compound characteristics
| Compound ID: | S529-0802 |
| Compound Name: | N-[2-(3-methylpiperidin-1-yl)ethyl]-2-(5-oxo-2-phenyl-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)acetamide |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C24 H31 N5 O2 |
| Smiles: | CC1CCCN(CCNC(CN2CCCc3c(cnc(c4ccccc4)n3)C2=O)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0381 |
| logD: | 0.5516 |
| logSw: | -2.8748 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.467 |
| InChI Key: | HBYKGYKULWONCT-SFHVURJKSA-N |