6-(azepan-1-yl)-N~2~-[2-(morpholin-4-yl)ethyl]-5-nitropyrimidine-2,4-diamine
Chemical Structure Depiction of
6-(azepan-1-yl)-N~2~-[2-(morpholin-4-yl)ethyl]-5-nitropyrimidine-2,4-diamine
6-(azepan-1-yl)-N~2~-[2-(morpholin-4-yl)ethyl]-5-nitropyrimidine-2,4-diamine
Compound characteristics
| Compound ID: | G786-0057 |
| Compound Name: | 6-(azepan-1-yl)-N~2~-[2-(morpholin-4-yl)ethyl]-5-nitropyrimidine-2,4-diamine |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C16 H27 N7 O3 |
| Smiles: | C1CCCN(CC1)c1c(c(N)nc(NCCN2CCOCC2)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.1756 |
| logD: | 2.0867 |
| logSw: | -2.443 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.104 |
| InChI Key: | CZYNDQIURNJAAA-UHFFFAOYSA-N |