2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]-N-(3-phenylpropyl)acetamide
Chemical Structure Depiction of
2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]-N-(3-phenylpropyl)acetamide
2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]-N-(3-phenylpropyl)acetamide
Compound characteristics
| Compound ID: | S529-0441 |
| Compound Name: | 2-[2-(methoxymethyl)-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl]-N-(3-phenylpropyl)acetamide |
| Molecular Weight: | 382.46 |
| Molecular Formula: | C21 H26 N4 O3 |
| Smiles: | COCc1ncc2C(N(CCCc2n1)CC(NCCCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.472 |
| logD: | 1.472 |
| logSw: | -2.2307 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.238 |
| InChI Key: | HKTQRKRCVDSXBK-UHFFFAOYSA-N |