AC1M0LRY
2-(14,14-dimethyl-13-oxa-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-(10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)benzoic acid
CAS: 893676-69-2
| Molecular Formula | C19H16N4O3S |
|---|---|
| Molecular Weight | 380.0943 g/mol |
| LogP | 3.5555 |
| Topological Polar Surface Area | 89.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 380.0943 |
| Monoisotopic Mass | 380.0943 |
| Heavy Atoms | 27 |
| Complexity | 1224.627 |
Chemical Identifiers
| CAS Number | 893676-69-2 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C4=NC(=NN4C=N3)C5=CC=CC=C5C(=O)O)C |
Product Overview
AC1M0LRY (CAS 893676-69-2), with molecular formula C19H16N4O3S and molecular weight 380.0943 g/mol. IUPAC: 2-(14,14-dimethyl-13-oxa-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.
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