N-{4-methyl-1-[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]pentyl}-N'-(3,4,5-trimethoxyphenyl)urea
Chemical Structure Depiction of
N-{4-methyl-1-[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]pentyl}-N'-(3,4,5-trimethoxyphenyl)urea
N-{4-methyl-1-[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]pentyl}-N'-(3,4,5-trimethoxyphenyl)urea
Compound characteristics
| Compound ID: | C794-1076 |
| Compound Name: | N-{4-methyl-1-[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]pentyl}-N'-(3,4,5-trimethoxyphenyl)urea |
| Molecular Weight: | 526.7 |
| Molecular Formula: | C28 H38 N4 O4 S |
| Smiles: | CC(C)CCC(c1c2CCN(C)Cc2sc1n1cccc1)NC(Nc1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8328 |
| logD: | 2.2731 |
| logSw: | -4.4125 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.857 |
| InChI Key: | NIIMPCVNCFEEPU-NRFANRHFSA-N |