methyl 2-[(4-{[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}piperazine-1-sulfonyl)methyl]benzoate
Chemical Structure Depiction of
methyl 2-[(4-{[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}piperazine-1-sulfonyl)methyl]benzoate
methyl 2-[(4-{[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}piperazine-1-sulfonyl)methyl]benzoate
Compound characteristics
| Compound ID: | V030-0720 |
| Compound Name: | methyl 2-[(4-{[6-(1-benzothiophen-2-yl)-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methyl}piperazine-1-sulfonyl)methyl]benzoate |
| Molecular Weight: | 671.24 |
| Molecular Formula: | C35 H31 Cl N4 O4 S2 |
| Salt: | not_available |
| Smiles: | COC(c1ccccc1CS(N1CCN(CC1)Cc1c(c2ccc(cc2)[Cl])nc2ccc(cn12)c1cc2ccccc2s1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.0161 |
| logD: | 7.0144 |
| logSw: | -6.4409 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 65.293 |
| InChI Key: | YNHHDXILXUQPPL-UHFFFAOYSA-N |