4-[4-(adamantan-1-yl)piperazin-1-yl]-6-(azepan-1-yl)-N-{4-[chloro(difluoro)methoxy]phenyl}-1,3,5-triazin-2-amine
Chemical Structure Depiction of
4-[4-(adamantan-1-yl)piperazin-1-yl]-6-(azepan-1-yl)-N-{4-[chloro(difluoro)methoxy]phenyl}-1,3,5-triazin-2-amine
4-[4-(adamantan-1-yl)piperazin-1-yl]-6-(azepan-1-yl)-N-{4-[chloro(difluoro)methoxy]phenyl}-1,3,5-triazin-2-amine
Compound characteristics
| Compound ID: | 8012-9365 |
| Compound Name: | 4-[4-(adamantan-1-yl)piperazin-1-yl]-6-(azepan-1-yl)-N-{4-[chloro(difluoro)methoxy]phenyl}-1,3,5-triazin-2-amine |
| Molecular Weight: | 588.14 |
| Molecular Formula: | C30 H40 Cl F2 N7 O |
| Smiles: | C1CCCN(CC1)c1nc(Nc2ccc(cc2)OC(F)(F)[Cl])nc(n1)N1CCN(CC1)C12CC3CC(CC(C3)C2)C1 |
| Stereo: | ACHIRAL |
| logP: | 9.3173 |
| logD: | 9.0726 |
| logSw: | -6.9725 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.691 |
| InChI Key: | VGVSDELDMKEKSF-UHFFFAOYSA-N |