4-{[(8-methyltetrazolo[1,5-a]quinoxalin-4-yl)amino]methyl}benzoic acid
Chemical Structure Depiction of
4-{[(8-methyltetrazolo[1,5-a]quinoxalin-4-yl)amino]methyl}benzoic acid
4-{[(8-methyltetrazolo[1,5-a]quinoxalin-4-yl)amino]methyl}benzoic acid
Compound characteristics
| Compound ID: | C301-2046 |
| Compound Name: | 4-{[(8-methyltetrazolo[1,5-a]quinoxalin-4-yl)amino]methyl}benzoic acid |
| Molecular Weight: | 334.34 |
| Molecular Formula: | C17 H14 N6 O2 |
| Smiles: | Cc1ccc2c(c1)n1c(c(NCc3ccc(cc3)C(O)=O)n2)nnn1 |
| Stereo: | ACHIRAL |
| logP: | 2.663 |
| logD: | -0.3085 |
| logSw: | -2.7066 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.107 |
| InChI Key: | JTIWWUGXWWQWQA-UHFFFAOYSA-N |