AC1NIPZC
2-(7,13-dimethyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-4-yl)benzoic acid
Also Known As: 2-(5,9-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)benzoic acid|2-(5,9-dimethyl-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)benzoic acid
CAS: 896076-45-2
| Molecular Formula | C20H18N4O2S |
|---|---|
| Molecular Weight | 378.11505 g/mol |
| LogP | 4.13742 |
| Topological Polar Surface Area | 80.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 378.11505 |
| Monoisotopic Mass | 378.11505 |
| Heavy Atoms | 27 |
| Complexity | 1223.899 |
Chemical Identifiers
| CAS Number | 896076-45-2 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C4=NC(=NN4C(=N3)C)C5=CC=CC=C5C(=O)O |
Product Overview
AC1NIPZC (CAS 896076-45-2), with molecular formula C20H18N4O2S and molecular weight 378.11505 g/mol. IUPAC: 2-(7,13-dimethyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-4-yl)benzoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
AC1NIPZC is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »