N'-(3-chlorophenyl)-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)urea
Chemical Structure Depiction of
N'-(3-chlorophenyl)-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)urea
N'-(3-chlorophenyl)-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | V006-1034 |
| Compound Name: | N'-(3-chlorophenyl)-N-(2-{4-[(3-methoxyphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)urea |
| Molecular Weight: | 526.05 |
| Molecular Formula: | C27 H28 Cl N3 O4 S |
| Smiles: | COc1cccc(c1)OCC1c2ccsc2CCN1C(CN(CC=C)C(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7056 |
| logD: | 5.7056 |
| logSw: | -5.8602 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.629 |
| InChI Key: | SKQLRRHUFRLGAM-DEOSSOPVSA-N |