N-(3-methylbutyl)-N-{2-oxo-2-[4-(phenoxymethyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-(3-methylbutyl)-N-{2-oxo-2-[4-(phenoxymethyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N'-(propan-2-yl)urea
N-(3-methylbutyl)-N-{2-oxo-2-[4-(phenoxymethyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V013-4424 |
| Compound Name: | N-(3-methylbutyl)-N-{2-oxo-2-[4-(phenoxymethyl)-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N'-(propan-2-yl)urea |
| Molecular Weight: | 457.63 |
| Molecular Formula: | C25 H35 N3 O3 S |
| Smiles: | CC(C)CCN(CC(N1CCc2c(ccs2)C1COc1ccccc1)=O)C(NC(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1607 |
| logD: | 5.1607 |
| logSw: | -4.9516 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.653 |
| InChI Key: | BPJJJLOJUAABGL-QFIPXVFZSA-N |