N'-(3-chlorophenyl)-N-(2-{4-[(2-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]urea
Chemical Structure Depiction of
N'-(3-chlorophenyl)-N-(2-{4-[(2-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]urea
N'-(3-chlorophenyl)-N-(2-{4-[(2-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]urea
Compound characteristics
| Compound ID: | V015-1229 |
| Compound Name: | N'-(3-chlorophenyl)-N-(2-{4-[(2-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(oxolan-2-yl)methyl]urea |
| Molecular Weight: | 558.07 |
| Molecular Formula: | C28 H29 Cl F N3 O4 S |
| Smiles: | C1CC(CN(CC(N2CCc3c(ccs3)C2COc2ccccc2F)=O)C(Nc2cccc(c2)[Cl])=O)OC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4079 |
| logD: | 5.4079 |
| logSw: | -5.8507 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.576 |
| InChI Key: | REKNOPHWVKEKAM-UHFFFAOYSA-N |