C28H22N4O6
TL;DR: C28H22N4O6 (CAS 1013987-70-6) is a chemical compound with molecular formula C28H22N4O6 and molecular weight 510.15393 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S,11S,12R,16S)-14-(2-methoxy-5-nitrophenyl)-13,15-dioxo-N-phenyl-10,14-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-2,4,6,8-tetraene-11-carboxamide
Also Known As: (8S,8aR,11aS,11bS)-10-(2-methoxy-5-nitrophenyl)-9,11-dioxo-N-phenyl-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Technical Specifications
| Molecular Formula | C28H22N4O6 |
| Molecular Weight | 510.15393 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 125.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 510.15393 Da |
| Heavy Atoms | 38 |
| Complexity | 1010.0 |
| SMILES | COC1=C(C=C(C=C1)[N+](=O)[O-])N2C(=O)[C@H]3[C@@H](C2=O)[C@H](N4[C@@H]3C5=CC=CC=C5C=C4)C(=O)NC6=CC=CC=C6 |
| InChIKey | APYOWEFPEDOEQV-LIONHTAISA-N |
Chemical Property Profile of C28H22N4O6
Property Insights of C28H22N4O6
The XLogP value of 3.2 indicates that C28H22N4O6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C28H22N4O6. Following Lipinski's Rule of Five, C28H22N4O6 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of C28H22N4O6?
The CAS number of C28H22N4O6 is 1013987-70-6.
What is the molecular formula of C28H22N4O6?
The molecular formula of C28H22N4O6 is C28H22N4O6.
What is the molecular weight of C28H22N4O6?
The molecular weight of C28H22N4O6 is 510.15393 g/mol.
Where can I buy C28H22N4O6?
You can request a quote for C28H22N4O6 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C28H22N4O6?
Yes, CoreyChem provides custom synthesis services for C28H22N4O6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.