EINECS 274-983-1
TL;DR: EINECS 274-983-1 (CAS 70892-22-7) is a chemical compound with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,9aS)-2,8-diamino-5,10-dihydroxy-3,7-dimethyl-2,9a-dihydroanthracene-1,9-dione
Also Known As: EINECS 274-983-1, 9,10-Anthracenedione, 1,8-diamino-4,5-dihydroxy-, methylated, (2R,9aS)-2,8-diamino-5,10-dihydroxy-3,7-dimethyl-2,9a-dihydroanthracene-1,9-dione
| Molecular Formula | C16H16N2O4 |
|---|---|
| Molecular Weight | 300.11 g/mol |
| LogP | 1.22072 |
| Topological Polar Surface Area | 126.64 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 300.111 |
| Heavy Atoms | 22 |
| Complexity | 804.8541 |
Chemical Identifiers
| CAS Number | 70892-22-7 |
|---|---|
| SMILES | CC1=CC2=C(C3=C(C=C(C(=C3C(=O)[C@H]2C(=O)[C@@H]1N)N)C)O)O |
Product Overview
EINECS 274-983-1 (CAS 70892-22-7), with molecular formula C16H16N2O4 and molecular weight 300.11 g/mol. IUPAC: (2R,9aS)-2,8-diamino-5,10-dihydroxy-3,7-dimethyl-2,9a-dihydroanthracene-1,9-dione.
Chemical Property Profile of EINECS 274-983-1
Property Insights of EINECS 274-983-1
The XLogP value of 1.22072 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 274-983-1. The TPSA of 126.64 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 274-983-1. Following Lipinski's Rule of Five, EINECS 274-983-1 has 4 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 EINECS 274-983-1?
The CAS number of EINECS 274-983-1 is 70892-22-7.
What is the molecular formula of EINECS 274-983-1?
The molecular formula of EINECS 274-983-1 is C16H16N2O4.
What is the molecular weight of EINECS 274-983-1?
The molecular weight of EINECS 274-983-1 is 300.11 g/mol.
Where can I buy EINECS 274-983-1?
You can request a quote for EINECS 274-983-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 274-983-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 274-983-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.