Einecs 240-573-6
TL;DR: Einecs 240-573-6 (CAS 71700-99-7) is a chemical compound with molecular formula C22H24N4O5S and molecular weight 456.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one;8-hydroxyquinoline-5-sulfonic acid
Also Known As: EINECS 240-573-6, EINECS 275-855-8, 8-Hydroxy-5-quinolinesulfonic acid - 4-(dimethylamino)-1,5-d, 8-Hydroxyquinoline-5-sulphonic acid, compound with 4-(dimethylamino)-1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one, 8-Hydroxyquinoline-5-sulphonic acid, compound with 4-(dimethylamino)-1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one (1:1)
| Molecular Formula | C22H24N4O5S |
|---|---|
| Molecular Weight | 456.15 g/mol |
| LogP | 2.73752 |
| Topological Polar Surface Area | 117.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 456.14673 |
| Heavy Atoms | 32 |
| Complexity | 1424.2311 |
Chemical Identifiers
| CAS Number | 71700-99-7 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C.C1=CC2=C(C=CC(=C2N=C1)O)S(=O)(=O)O |
Product Overview
Einecs 240-573-6 (CAS 71700-99-7), with molecular formula C22H24N4O5S and molecular weight 456.15 g/mol. IUPAC: 4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one;8-hydroxyquinoline-5-sulfonic acid.
Chemical Property Profile of Einecs 240-573-6
Property Insights of Einecs 240-573-6
The XLogP value of 2.73752 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Einecs 240-573-6. The TPSA of 117.66 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 240-573-6. Following Lipinski's Rule of Five, Einecs 240-573-6 has 2 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 240-573-6?
The CAS number of Einecs 240-573-6 is 71700-99-7.
What is the molecular formula of Einecs 240-573-6?
The molecular formula of Einecs 240-573-6 is C22H24N4O5S.
What is the molecular weight of Einecs 240-573-6?
The molecular weight of Einecs 240-573-6 is 456.15 g/mol.
Where can I buy Einecs 240-573-6?
You can request a quote for Einecs 240-573-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 240-573-6?
Yes, KEHONG BIO provides custom synthesis services for Einecs 240-573-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.