4-[6-(3-chloro-4-fluorophenoxy)pyrimidin-4-yl]-N-ethyl-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[6-(3-chloro-4-fluorophenoxy)pyrimidin-4-yl]-N-ethyl-1,4-diazepane-1-carboxamide
4-[6-(3-chloro-4-fluorophenoxy)pyrimidin-4-yl]-N-ethyl-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | V027-9556 |
| Compound Name: | 4-[6-(3-chloro-4-fluorophenoxy)pyrimidin-4-yl]-N-ethyl-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 393.85 |
| Molecular Formula: | C18 H21 Cl F N5 O2 |
| Salt: | not_available |
| Smiles: | CCNC(N1CCCN(CC1)c1cc(ncn1)Oc1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1548 |
| logD: | 3.1548 |
| logSw: | -3.6652 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.44 |
| InChI Key: | UERVUPVBOYQVKZ-UHFFFAOYSA-N |