N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N'-(propan-2-yl)-N-(prop-2-en-1-yl)urea
Chemical Structure Depiction of
N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N'-(propan-2-yl)-N-(prop-2-en-1-yl)urea
N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N'-(propan-2-yl)-N-(prop-2-en-1-yl)urea
Compound characteristics
| Compound ID: | V013-9899 |
| Compound Name: | N-(2-{4-[(3-fluorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N'-(propan-2-yl)-N-(prop-2-en-1-yl)urea |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C23 H28 F N3 O3 S |
| Smiles: | CC(C)NC(N(CC=C)CC(N1CCc2c(ccs2)C1COc1cccc(c1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2319 |
| logD: | 4.2319 |
| logSw: | -4.2203 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.653 |
| InChI Key: | AQZGIQXQPLWQOB-FQEVSTJZSA-N |