N-[(3-fluorophenyl)methyl]-2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide
Chemical Structure Depiction of
N-[(3-fluorophenyl)methyl]-2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide
N-[(3-fluorophenyl)methyl]-2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide
Compound characteristics
| Compound ID: | S529-0456 |
| Compound Name: | N-[(3-fluorophenyl)methyl]-2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide |
| Molecular Weight: | 372.4 |
| Molecular Formula: | C19 H21 F N4 O3 |
| Smiles: | COCc1ncc2C(N(CCCc2n1)CC(NCc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8848 |
| logD: | 0.8848 |
| logSw: | -2.1336 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.396 |
| InChI Key: | DLFHYUFGRLPTFB-UHFFFAOYSA-N |