2-[(cyclopropylmethyl)(2-hydroxyhex-5-en-1-yl)amino]-1-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Chemical Structure Depiction of
2-[(cyclopropylmethyl)(2-hydroxyhex-5-en-1-yl)amino]-1-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
2-[(cyclopropylmethyl)(2-hydroxyhex-5-en-1-yl)amino]-1-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | V022-6891 |
| Compound Name: | 2-[(cyclopropylmethyl)(2-hydroxyhex-5-en-1-yl)amino]-1-[4-{[4-(propan-2-yl)phenoxy]methyl}-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl]ethan-1-one |
| Molecular Weight: | 496.71 |
| Molecular Formula: | C29 H40 N2 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)OCC1c2ccsc2CCN1C(CN(CC1CC1)CC(CCC=C)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0356 |
| logD: | 5.8203 |
| logSw: | -5.416 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.93 |
| InChI Key: | BRVAUMFGJHTJJX-UHFFFAOYSA-N |