AC1NIN2Z
2-[10-(4-methoxyphenyl)-12,14-dioxo-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraen-13-yl]benzoic acid
Also Known As: 2-((11AS)-5-(4-methoxyphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl)benzoic acid|2-[(15S)-10-(4-Methoxyphenyl)-12,14-dioxo-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraen-13-yl]benzoic acid|2-[5-(4-methoxyphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]benzoic acid
| Molecular Formula | C27H21N3O5 |
|---|---|
| Molecular Weight | 467.14813 g/mol |
| LogP | 4.3576 |
| Topological Polar Surface Area | 102.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 467.14813 |
| Monoisotopic Mass | 467.14813 |
| Heavy Atoms | 35 |
| Complexity | 1507.0425 |
Chemical Identifiers
| CAS Number | 956919-29-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2C3=C(CC4N2C(=O)N(C4=O)C5=CC=CC=C5C(=O)O)C6=CC=CC=C6N3 |
Product Overview
AC1NIN2Z (CAS 956919-29-2), with molecular formula C27H21N3O5 and molecular weight 467.14813 g/mol. IUPAC: 2-[10-(4-methoxyphenyl)-12,14-dioxo-8,11,13-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6-tetraen-13-yl]benzoic acid.
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