N'-ethyl-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N-[2-(pyrrolidin-1-yl)ethyl]urea
Chemical Structure Depiction of
N'-ethyl-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N-[2-(pyrrolidin-1-yl)ethyl]urea
N'-ethyl-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N-[2-(pyrrolidin-1-yl)ethyl]urea
Compound characteristics
| Compound ID: | V022-0647 |
| Compound Name: | N'-ethyl-N-{2-oxo-2-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethyl}-N-[2-(pyrrolidin-1-yl)ethyl]urea |
| Molecular Weight: | 512.71 |
| Molecular Formula: | C28 H40 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCNC(N(CCN1CCCC1)CC(N1CCc2c(ccs2)C1COc1ccc(cc1)C(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6157 |
| logD: | 1.0775 |
| logSw: | -4.0969 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.382 |
| InChI Key: | YLCULVAMBFSYOG-VWLOTQADSA-N |