2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(3-{[1-(propan-2-yl)piperidin-4-yl]oxy}propyl)acetamide
Chemical Structure Depiction of
2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(3-{[1-(propan-2-yl)piperidin-4-yl]oxy}propyl)acetamide
2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(3-{[1-(propan-2-yl)piperidin-4-yl]oxy}propyl)acetamide
Compound characteristics
| Compound ID: | S529-0387 |
| Compound Name: | 2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-(3-{[1-(propan-2-yl)piperidin-4-yl]oxy}propyl)acetamide |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C24 H37 N5 O3 |
| Smiles: | CC(C)N1CCC(CC1)OCCCNC(CN1CCCc2c(cnc(C3CC3)n2)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8733 |
| logD: | -1.8905 |
| logSw: | -1.9958 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.063 |
| InChI Key: | ZBNDVLJMXCKNJN-UHFFFAOYSA-N |