N'-(3-chlorophenyl)-N-(2-{4-[(2,4-dimethylphenoxy)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-[(2,4-dimethylphenoxy)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-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | V022-0257 |
| Compound Name: | N'-(3-chlorophenyl)-N-(2-{4-[(2,4-dimethylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(prop-2-en-1-yl)urea |
| Molecular Weight: | 524.08 |
| Molecular Formula: | C28 H30 Cl N3 O3 S |
| Smiles: | Cc1ccc(c(C)c1)OCC1c2ccsc2CCN1C(CN(CC=C)C(Nc1cccc(c1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.907 |
| logD: | 6.907 |
| logSw: | -6.2843 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.172 |
| InChI Key: | DYMTVDAMEDHDBK-DEOSSOPVSA-N |