NCI60_039406
TL;DR: NCI60_039406 (CAS 87227-03-0) is a chemical compound with molecular formula C24H23NO6 and molecular weight 421.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,6,7-tetramethoxy-9,12,13,13a-tetrahydrophenanthro[9,10-f]indolizine-11,14-dione
Also Known As: NCI60_039406, (13aS)-13,13a-Dihydro-2,3,6,7-tetramethoxydibenzo[f,h]pyrrolo[1,2-b]isoquinoline-11,14(9H,12H)-dione, 2,3,6,7-Tetramethoxy-12,12a-dihydro-9H,11H-9a-aza-cyclopenta[b]triphenylene-10,13-dione, 2,3,6,7-tetramethoxy-9,12,13,13a-tetrahydrophenanthro[9,10-f]indolizine-11,14-dione, 2,6,7-Tetramethoxy-12,12a-dihydro-9H,11H-9a-aza-cyclopenta[b]triphenylene-10,13-dione
| Molecular Formula | C24H23NO6 |
|---|---|
| Molecular Weight | 421.15 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.15253 |
| Heavy Atoms | 31 |
| Complexity | 714.0 |
Chemical Identifiers
| CAS Number | 87227-03-0 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C3=C(C4=CC(=C(C=C24)OC)OC)C(=O)C5CCC(=O)N5C3)OC |
| InChIKey | OFQHMVDOZPGFQM-UHFFFAOYSA-N |
Product Overview
NCI60_039406 (CAS 87227-03-0), with molecular formula C24H23NO6 and molecular weight 421.15 g/mol. IUPAC: 2,3,6,7-tetramethoxy-9,12,13,13a-tetrahydrophenanthro[9,10-f]indolizine-11,14-dione.
Chemical Property Profile of NCI60_039406
Property Insights of NCI60_039406
The XLogP value of 3.3 indicates that NCI60_039406 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for NCI60_039406. Following Lipinski's Rule of Five, NCI60_039406 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of NCI60_039406?
The CAS number of NCI60_039406 is 87227-03-0.
What is the molecular formula of NCI60_039406?
The molecular formula of NCI60_039406 is C24H23NO6.
What is the molecular weight of NCI60_039406?
The molecular weight of NCI60_039406 is 421.15 g/mol.
Where can I buy NCI60_039406?
You can request a quote for NCI60_039406 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCI60_039406?
Yes, KEHONG BIO provides custom synthesis services for NCI60_039406 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.