2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
Chemical Structure Depiction of
2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
Compound characteristics
| Compound ID: | S529-0334 |
| Compound Name: | 2-(2-cyclopropyl-5-oxo-5,7,8,9-tetrahydro-6H-pyrimido[5,4-c]azepin-6-yl)-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide |
| Molecular Weight: | 433.51 |
| Molecular Formula: | C24 H27 N5 O3 |
| Smiles: | COc1ccc2c(c1)c(CCNC(CN1CCCc3c(cnc(C4CC4)n3)C1=O)=O)c[nH]2 |
| Stereo: | ACHIRAL |
| logP: | 1.863 |
| logD: | 1.8629 |
| logSw: | -2.6729 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.489 |
| InChI Key: | RVIJXIMEOCHYLS-UHFFFAOYSA-N |