AO-081/15245270
TL;DR: AO-081/15245270 (CAS 1164545-20-3) is a chemical compound with molecular formula C26H24ClN5O4 and molecular weight 505.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(4-chlorophenyl)-2-cyano-3-[2,5-dimethyl-1-(4-morpholin-4-yl-3-nitrophenyl)pyrrol-3-yl]prop-2-enamide
Also Known As: AO-081/15245270, (E)-N-(4-Chloro-phenyl)-2-cyano-3-[2,5-dimethyl-1-(4-morpholin-4-yl-3-nitro-phenyl)-1H-pyrrol-3-yl]-acrylamide, (E)-N-(4-chlorophenyl)-2-cyano-3-[2,5-dimethyl-1-(4-morpholin-4-yl-3-nitrophenyl)pyrrol-3-yl]prop-2-enamide, (2E)-N-(4-chlorophenyl)-2-cyano-3-{2,5-dimethyl-1-[4-(morpholin-4-yl)-3-nitrophenyl]-1H-pyrrol-3-yl}prop-2-enamide, (E)-N-(4-chlorophenyl)-2-cyano-3-(2,5-dimethyl-1-(4-morpholino-3-nitrophenyl)-1H-pyrrol-3-yl)acrylamide
| Molecular Formula | C26H24ClN5O4 |
|---|---|
| Molecular Weight | 505.15 g/mol |
| LogP | 5.03802 |
| Topological Polar Surface Area | 113.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 505.15167 |
| Heavy Atoms | 36 |
| Complexity | 1382.5514 |
Chemical Identifiers
| CAS Number | 1164545-20-3 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C)/C=C(\C#N)/C(=O)NC4=CC=C(C=C4)Cl |
Product Overview
AO-081/15245270 (CAS 1164545-20-3), with molecular formula C26H24ClN5O4 and molecular weight 505.15 g/mol. IUPAC: (E)-N-(4-chlorophenyl)-2-cyano-3-[2,5-dimethyl-1-(4-morpholin-4-yl-3-nitrophenyl)pyrrol-3-yl]prop-2-enamide.
Chemical Property Profile of AO-081/15245270
Property Insights of AO-081/15245270
The XLogP value of 5.03802 indicates that AO-081/15245270 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/15245270. Following Lipinski's Rule of Five, AO-081/15245270 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AO-081/15245270?
The CAS number of AO-081/15245270 is 1164545-20-3.
What is the molecular formula of AO-081/15245270?
The molecular formula of AO-081/15245270 is C26H24ClN5O4.
What is the molecular weight of AO-081/15245270?
The molecular weight of AO-081/15245270 is 505.15 g/mol.
Where can I buy AO-081/15245270?
You can request a quote for AO-081/15245270 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/15245270?
Yes, KEHONG BIO provides custom synthesis services for AO-081/15245270 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.