BAS 01577873
TL;DR: BAS 01577873 (CAS 6107-17-1) is a chemical compound with molecular formula C18H17BrN2O4 and molecular weight 404.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[5-(4-bromophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid
Also Known As: BAS 01577873, BIM-0008399.P001, AF-399/15285039, 5-[3-(4-bromophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid, 5-[3-(4-bromophenyl)-5-(2-furyl)(2-pyrazolinyl)]-5-oxopentanoic acid
| Molecular Formula | C18H17BrN2O4 |
|---|---|
| Molecular Weight | 404.04 g/mol |
| LogP | 3.9747 |
| Topological Polar Surface Area | 83.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.03717 |
| Heavy Atoms | 25 |
| Complexity | 783.91724 |
Chemical Identifiers
| CAS Number | 6107-17-1 |
|---|---|
| SMILES | C1C(N(N=C1C2=CC=C(C=C2)Br)C(=O)CCCC(=O)O)C3=CC=CO3 |
Product Overview
BAS 01577873 (CAS 6107-17-1), with molecular formula C18H17BrN2O4 and molecular weight 404.04 g/mol. IUPAC: 5-[5-(4-bromophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid.
Chemical Property Profile of BAS 01577873
Property Insights of BAS 01577873
The XLogP value of 3.9747 indicates that BAS 01577873 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.11 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01577873. Following Lipinski's Rule of Five, BAS 01577873 has 1 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 01577873?
The CAS number of BAS 01577873 is 6107-17-1.
What is the molecular formula of BAS 01577873?
The molecular formula of BAS 01577873 is C18H17BrN2O4.
What is the molecular weight of BAS 01577873?
The molecular weight of BAS 01577873 is 404.04 g/mol.
Where can I buy BAS 01577873?
You can request a quote for BAS 01577873 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01577873?
Yes, KEHONG BIO provides custom synthesis services for BAS 01577873 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.