(4-chloro-2-methoxyphenyl){4-[(6-fluoro-1,3-benzoxazol-2-yl)methyl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(4-chloro-2-methoxyphenyl){4-[(6-fluoro-1,3-benzoxazol-2-yl)methyl]-1,4-diazepan-1-yl}methanone
(4-chloro-2-methoxyphenyl){4-[(6-fluoro-1,3-benzoxazol-2-yl)methyl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | M280-1016 |
| Compound Name: | (4-chloro-2-methoxyphenyl){4-[(6-fluoro-1,3-benzoxazol-2-yl)methyl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 417.87 |
| Molecular Formula: | C21 H21 Cl F N3 O3 |
| Smiles: | COc1cc(ccc1C(N1CCCN(CC1)Cc1nc2ccc(cc2o1)F)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8292 |
| logD: | 3.8256 |
| logSw: | -4.2524 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.136 |
| InChI Key: | RYKLOJCXSPARBZ-UHFFFAOYSA-N |