NGZUXMCZDIFIEO-UHFFFAOYSA-N
[4-(1,8-dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)phenyl] heptanoate
Also Known As: AK-918/11939002|4-(1,8-dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)phenyl heptanoate|4-(1,8-dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)phenyl heptanoate (non-preferred name)|[4-(1,8-Dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)phenyl] heptanoate
| Molecular Formula | C31H27Br2NO4 |
|---|---|
| Molecular Weight | 635.0307 g/mol |
| LogP | 6.9722 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 635.0307 |
| Monoisotopic Mass | 637.0286 |
| Heavy Atoms | 38 |
| Complexity | 1328.7434 |
Chemical Identifiers
| CAS Number | 488785-91-7 |
|---|---|
| SMILES | CCCCCCC(=O)OC1=CC=C(C=C1)N2C(=O)C3C(C2=O)C4(C5=CC=CC=C5C3(C6=CC=CC=C64)Br)Br |
Product Overview
NGZUXMCZDIFIEO-UHFFFAOYSA-N (CAS 488785-91-7), with molecular formula C31H27Br2NO4 and molecular weight 635.0307 g/mol. IUPAC: [4-(1,8-dibromo-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl)phenyl] heptanoate.
NGZUXMCZDIFIEO-UHFFFAOYSA-N is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »