AN-655/15641051
TL;DR: AN-655/15641051 (CAS 486994-46-1) 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.
2-ethoxy-3-nitro-4-(2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl)phenol
Also Known As: AN-655/15641051, 2-ethoxy-3-nitro-4-(2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl)phenol, 2-ethoxy-3-nitro-4-[2-(2-thienyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenol, 2-ethoxy-3-nitro-4-(2-thien-2-yl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)phenol, 2-ethoxy-3-nitro-4-[2-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl]phenol
| Molecular Formula | C22H19N3O5S |
|---|---|
| Molecular Weight | 437.10 g/mol |
| LogP | 5.0029 |
| Topological Polar Surface Area | 97.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.10455 |
| Heavy Atoms | 31 |
| Complexity | 1177.8944 |
Chemical Identifiers
| CAS Number | 486994-46-1 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1[N+](=O)[O-])C2N3C(CC(=N3)C4=CC=CS4)C5=CC=CC=C5O2)O |
Product Overview
AN-655/15641051 (CAS 486994-46-1), with molecular formula C22H19N3O5S and molecular weight 437.10 g/mol. IUPAC: 2-ethoxy-3-nitro-4-(2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl)phenol.
Chemical Property Profile of AN-655/15641051
Property Insights of AN-655/15641051
The XLogP value of 5.0029 indicates that AN-655/15641051 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-655/15641051. Following Lipinski's Rule of Five, AN-655/15641051 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-655/15641051?
The CAS number of AN-655/15641051 is 486994-46-1.
What is the molecular formula of AN-655/15641051?
The molecular formula of AN-655/15641051 is C22H19N3O5S.
What is the molecular weight of AN-655/15641051?
The molecular weight of AN-655/15641051 is 437.10 g/mol.
Where can I buy AN-655/15641051?
You can request a quote for AN-655/15641051 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-655/15641051?
Yes, KEHONG BIO provides custom synthesis services for AN-655/15641051 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.