EINECS 264-699-6
TL;DR: EINECS 264-699-6 (CAS 64135-01-9) is a chemical compound with molecular formula C22H19N3O5S and molecular weight 437.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4-[4-(methylaminomethyl)anilino]-9,10-dioxoanthracene-2-sulfonic acid
Also Known As: 1-Amino-9,10-dihydro-4-((4-((methylamino)methyl)phenyl)amino)-9,10-dioxoanthracene-2-sulphonic acid, 1-amino-9,10-dihydro-4-[[4-[(methylamino)methyl]phenyl]amino]-9,10-dioxoanthracene-2-sulphonic acid, 1-amino-4-({4-[(methylamino)methyl]phenyl}amino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid, 1-amino-4-[4-(methylaminomethyl)anilino]-9,10-dioxoanthracene-2-sulfonic acid, 1-amino-9,10-dihydro-4-[[4-[ methyl]phenyl]amino]-9,10-dioxoanthracene-2-sulphonicacid
| Molecular Formula | C22H19N3O5S |
|---|---|
| Molecular Weight | 437.10 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.10455 |
| Heavy Atoms | 31 |
| Complexity | 789.0 |
Chemical Identifiers
| CAS Number | 64135-01-9 |
|---|---|
| SMILES | CNCC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O |
| InChIKey | YCUWKANYCKONNX-UHFFFAOYSA-N |
Product Overview
EINECS 264-699-6 (CAS 64135-01-9), with molecular formula C22H19N3O5S and molecular weight 437.10 g/mol. IUPAC: 1-amino-4-[4-(methylaminomethyl)anilino]-9,10-dioxoanthracene-2-sulfonic acid.
Chemical Property Profile of EINECS 264-699-6
Property Insights of EINECS 264-699-6
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 264-699-6. The TPSA of 147.0 Ų indicates high polarity, suggesting EINECS 264-699-6 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 264-699-6 has 4 hydrogen bond donor(s) and 8 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 264-699-6?
The CAS number of EINECS 264-699-6 is 64135-01-9.
What is the molecular formula of EINECS 264-699-6?
The molecular formula of EINECS 264-699-6 is C22H19N3O5S.
What is the molecular weight of EINECS 264-699-6?
The molecular weight of EINECS 264-699-6 is 437.10 g/mol.
Where can I buy EINECS 264-699-6?
You can request a quote for EINECS 264-699-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 264-699-6?
Yes, KEHONG BIO provides custom synthesis services for EINECS 264-699-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.