N-(2,4-difluorophenyl)-2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide
N-(2,4-difluorophenyl)-2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide
Compound characteristics
| Compound ID: | S529-0434 |
| Compound Name: | N-(2,4-difluorophenyl)-2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]acetamide |
| Molecular Weight: | 376.36 |
| Molecular Formula: | C18 H18 F2 N4 O3 |
| Smiles: | COCc1ncc2C(N(CCCc2n1)CC(Nc1ccc(cc1F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0589 |
| logD: | 1.0503 |
| logSw: | -2.2621 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.376 |
| InChI Key: | GPHNZYAMFGDWED-UHFFFAOYSA-N |