methyl 2-{1-methyl-3-[(N-phenylbenzamido)methyl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-sulfonyl}benzoate
Chemical Structure Depiction of
methyl 2-{1-methyl-3-[(N-phenylbenzamido)methyl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-sulfonyl}benzoate
methyl 2-{1-methyl-3-[(N-phenylbenzamido)methyl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-sulfonyl}benzoate
Compound characteristics
| Compound ID: | L871-0426 |
| Compound Name: | methyl 2-{1-methyl-3-[(N-phenylbenzamido)methyl]-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-sulfonyl}benzoate |
| Molecular Weight: | 544.63 |
| Molecular Formula: | C29 H28 N4 O5 S |
| Smiles: | Cn1c2CCN(Cc2c(CN(C(c2ccccc2)=O)c2ccccc2)n1)S(c1ccccc1C(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5744 |
| logD: | 3.5744 |
| logSw: | -3.8103 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.649 |
| InChI Key: | ZYZKBZHSAYUJFR-UHFFFAOYSA-N |