6-chloro-3-{2-[3-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-chloro-3-{2-[3-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
6-chloro-3-{2-[3-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | G305-0631 |
| Compound Name: | 6-chloro-3-{2-[3-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 416.86 |
| Molecular Formula: | C21 H21 Cl N2 O5 |
| Smiles: | COc1ccc(c(c1)C1CCN(C1)C(CN1C(=O)Oc2cc(ccc12)[Cl])=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7653 |
| logD: | 3.7653 |
| logSw: | -4.4213 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.661 |
| InChI Key: | HTFNNVCJXFIKQO-ZDUSSCGKSA-N |