BAS 00549520
TL;DR: BAS 00549520 (CAS 75491-60-0) is a chemical compound with molecular formula C18H24N4O4 and molecular weight 360.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N'-(2-hydroxyethyl)-N'-methylbutanediamide
Also Known As: BAS 00549520, AE-641/00390053, N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N'-(2-hydroxyethyl)-N'-methylbutanediamide, N'-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-N-(2-hydroxyethyl)-N-methylbutanediamide, N'-(2,3-dimethyl-5-oxo-1-phenyl(3-pyrazolin-4-yl))-N-(2-hydroxyethyl)-N-methyl butane-1,4-diamide
| Molecular Formula | C18H24N4O4 |
|---|---|
| Molecular Weight | 360.18 g/mol |
| LogP | 0.65382 |
| Topological Polar Surface Area | 96.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 360.17975 |
| Heavy Atoms | 26 |
| Complexity | 838.8663 |
Chemical Identifiers
| CAS Number | 75491-60-0 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCC(=O)N(C)CCO |
Product Overview
BAS 00549520 (CAS 75491-60-0), with molecular formula C18H24N4O4 and molecular weight 360.18 g/mol. IUPAC: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N'-(2-hydroxyethyl)-N'-methylbutanediamide.
Chemical Property Profile of BAS 00549520
Property Insights of BAS 00549520
The XLogP value of 0.65382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00549520. The TPSA of 96.57 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00549520. Following Lipinski's Rule of Five, BAS 00549520 has 2 hydrogen bond donor(s) and 4 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 BAS 00549520?
The CAS number of BAS 00549520 is 75491-60-0.
What is the molecular formula of BAS 00549520?
The molecular formula of BAS 00549520 is C18H24N4O4.
What is the molecular weight of BAS 00549520?
The molecular weight of BAS 00549520 is 360.18 g/mol.
Where can I buy BAS 00549520?
You can request a quote for BAS 00549520 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00549520?
Yes, KEHONG BIO provides custom synthesis services for BAS 00549520 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.