AC1L4AAA
4,8-dihydroxy-6-methoxy-3-methyl-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
Also Known As: 1,2,3,10,11,11a-Hexahydro-2,9-dihydroxy-11-methoxy-8-methyl-5H-pyrrolo(2,1-c)(1,4)benzodiazepin-5-one|5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 1,2,3,10,11,11a-hexahydro-2,9-dihydroxy-11-methoxy-8-methyl-|2,9-Dihydroxy-11-methoxy-8-methyl-1,2,3,10,11,11a-hexahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-5-one|4,8-dihydroxy-6-methoxy-3-methyl-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
| Molecular Formula | C14H18N2O4 |
|---|---|
| Molecular Weight | 278.12665 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 82.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.12665 |
| Monoisotopic Mass | 278.12665 |
| Heavy Atoms | 20 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 72435-85-9 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)C(=O)N3CC(CC3C(N2)OC)O)O |
| InChIKey | STMNPXSOIJUABF-UHFFFAOYSA-N |
Product Overview
AC1L4AAA (CAS 72435-85-9), with molecular formula C14H18N2O4 and molecular weight 278.12665 g/mol. IUPAC: 4,8-dihydroxy-6-methoxy-3-methyl-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one.
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