N-[2-(morpholin-4-yl)ethyl]-2-[5-oxo-2-(pyridin-4-yl)-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide
Chemical Structure Depiction of
N-[2-(morpholin-4-yl)ethyl]-2-[5-oxo-2-(pyridin-4-yl)-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide
N-[2-(morpholin-4-yl)ethyl]-2-[5-oxo-2-(pyridin-4-yl)-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide
Compound characteristics
| Compound ID: | S529-0666 |
| Compound Name: | N-[2-(morpholin-4-yl)ethyl]-2-[5-oxo-2-(pyridin-4-yl)-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide |
| Molecular Weight: | 410.47 |
| Molecular Formula: | C21 H26 N6 O3 |
| Smiles: | C1Cc2c(cnc(c3ccncc3)n2)C(N(C1)CC(NCCN1CCOCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.4999 |
| logD: | -0.5473 |
| logSw: | -1.5174 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.871 |
| InChI Key: | JVLAULBWZKYNAR-UHFFFAOYSA-N |