N-(4-bromophenyl)-N'-{4-methyl-1-[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]pentyl}urea
Chemical Structure Depiction of
N-(4-bromophenyl)-N'-{4-methyl-1-[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]pentyl}urea
N-(4-bromophenyl)-N'-{4-methyl-1-[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]pentyl}urea
Compound characteristics
Compound ID: | C794-1075 |
Compound Name: | N-(4-bromophenyl)-N'-{4-methyl-1-[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]pentyl}urea |
Molecular Weight: | 515.52 |
Molecular Formula: | C25 H31 Br N4 O S |
Smiles: | CC(C)CCC(c1c2CCN(C)Cc2sc1n1cccc1)NC(Nc1ccc(cc1)[Br])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 6.2861 |
logD: | 3.7265 |
logSw: | -5.4561 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 41.879 |
InChI Key: | BUBPACAMFNRYID-NRFANRHFSA-N |