N'-(3-chlorophenyl)-N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)urea
Chemical Structure Depiction of
N'-(3-chlorophenyl)-N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)urea
N'-(3-chlorophenyl)-N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)urea
Compound characteristics
| Compound ID: | V021-1873 |
| Compound Name: | N'-(3-chlorophenyl)-N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(2-methylbutyl)urea |
| Molecular Weight: | 544.09 |
| Molecular Formula: | C28 H31 Cl F N3 O3 S |
| Smiles: | CCC(C)CN(CC(N1CCc2c(ccs2)C1COc1cccc(c1)F)=O)C(Nc1cccc(c1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.0182 |
| logD: | 7.0182 |
| logSw: | -6.3508 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.107 |
| InChI Key: | DNHNHEQSKYIKCS-UHFFFAOYSA-N |