N'-tert-butyl-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]urea
Chemical Structure Depiction of
N'-tert-butyl-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]urea
N'-tert-butyl-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]urea
Compound characteristics
| Compound ID: | V023-0043 |
| Compound Name: | N'-tert-butyl-N-(2-{4-[(4-chlorophenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-[(furan-2-yl)methyl]urea |
| Molecular Weight: | 516.06 |
| Molecular Formula: | C26 H30 Cl N3 O4 S |
| Smiles: | CC(C)(C)NC(N(CC(N1CCc2c(ccs2)C1COc1ccc(cc1)[Cl])=O)Cc1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5234 |
| logD: | 5.5234 |
| logSw: | -5.9087 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.002 |
| InChI Key: | HACPKZFIOQGRRC-QFIPXVFZSA-N |