N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)-N'-propylurea
Chemical Structure Depiction of
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)-N'-propylurea
N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)-N'-propylurea
Compound characteristics
| Compound ID: | V002-2298 |
| Compound Name: | N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)-N'-propylurea |
| Molecular Weight: | 476.04 |
| Molecular Formula: | C24 H30 Cl N3 O3 S |
| Smiles: | CCCNC(N(CC=C)CC(N1CCc2c(ccs2)C1COc1ccc(c(C)c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5201 |
| logD: | 5.5201 |
| logSw: | -5.9695 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.521 |
| InChI Key: | YUDUKRKZEPXIKH-NRFANRHFSA-N |