AO-081/40671556
TL;DR: AO-081/40671556 (CAS 498532-46-0) is a chemical compound with molecular formula C20H18Cl2N2O4S and molecular weight 452.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[benzenesulfonyl-[(3,4-dichlorophenyl)methyl]amino]-N-(furan-2-ylmethyl)acetamide
Also Known As: AO-081/40671556, 2-[benzenesulfonyl-[(3,4-dichlorophenyl)methyl]amino]-N-(furan-2-ylmethyl)acetamide, N~2~-(3,4-dichlorobenzyl)-N-(furan-2-ylmethyl)-N~2~-(phenylsulfonyl)glycinamide, 2-[(3,4-dichlorobenzyl)(phenylsulfonyl)amino]-N-(2-furylmethyl)acetamide, 2-{N-[(3,4-DICHLOROPHENYL)METHYL]BENZENESULFONAMIDO}-N-(FURAN-2-YLMETHYL)ACETAMIDE
| Molecular Formula | C20H18Cl2N2O4S |
|---|---|
| Molecular Weight | 452.04 g/mol |
| LogP | 4.0937 |
| Topological Polar Surface Area | 79.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 452.03644 |
| Heavy Atoms | 29 |
| Complexity | 1071.1254 |
Chemical Identifiers
| CAS Number | 498532-46-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC(=C(C=C2)Cl)Cl)CC(=O)NCC3=CC=CO3 |
Product Overview
AO-081/40671556 (CAS 498532-46-0), with molecular formula C20H18Cl2N2O4S and molecular weight 452.04 g/mol. IUPAC: 2-[benzenesulfonyl-[(3,4-dichlorophenyl)methyl]amino]-N-(furan-2-ylmethyl)acetamide.
Chemical Property Profile of AO-081/40671556
Property Insights of AO-081/40671556
The XLogP value of 4.0937 indicates that AO-081/40671556 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.62 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/40671556. Following Lipinski's Rule of Five, AO-081/40671556 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 AO-081/40671556?
The CAS number of AO-081/40671556 is 498532-46-0.
What is the molecular formula of AO-081/40671556?
The molecular formula of AO-081/40671556 is C20H18Cl2N2O4S.
What is the molecular weight of AO-081/40671556?
The molecular weight of AO-081/40671556 is 452.04 g/mol.
Where can I buy AO-081/40671556?
You can request a quote for AO-081/40671556 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/40671556?
Yes, KEHONG BIO provides custom synthesis services for AO-081/40671556 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.