AO-081/15384026
TL;DR: AO-081/15384026 (CAS 347333-65-7) is a chemical compound with molecular formula C25H29N5O5 and molecular weight 479.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[2,5-dimethyl-1-(4-morpholin-4-yl-3-nitrophenyl)pyrrol-3-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide
Also Known As: AO-081/15384026, 2-cyano-3-{1-[3-nitro-4-(4-morpholinyl)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}-N-(tetrahydro-2-furanylmethyl)acrylamide, (E)-2-cyano-3-[2,5-dimethyl-1-(4-morpholin-4-yl-3-nitrophenyl)pyrrol-3-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide, (2E)-2-cyano-3-{2,5-dimethyl-1-[4-(morpholin-4-yl)-3-nitrophenyl]-1H-pyrrol-3-yl}-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide, (E)-2-cyano-3-(2,5-dimethyl-1-(4-morpholino-3-nitrophenyl)-1H-pyrrol-3-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide
| Molecular Formula | C25H29N5O5 |
|---|---|
| Molecular Weight | 479.22 g/mol |
| LogP | 3.04112 |
| Topological Polar Surface Area | 122.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 479.21686 |
| Heavy Atoms | 35 |
| Complexity | 1183.585 |
Chemical Identifiers
| CAS Number | 347333-65-7 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C)/C=C(\C#N)/C(=O)NCC4CCCO4 |
Product Overview
AO-081/15384026 (CAS 347333-65-7), with molecular formula C25H29N5O5 and molecular weight 479.22 g/mol. IUPAC: (E)-2-cyano-3-[2,5-dimethyl-1-(4-morpholin-4-yl-3-nitrophenyl)pyrrol-3-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide.
Chemical Property Profile of AO-081/15384026
Property Insights of AO-081/15384026
The XLogP value of 3.04112 indicates that AO-081/15384026 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.66 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-081/15384026. Following Lipinski's Rule of Five, AO-081/15384026 has 1 hydrogen bond donor(s) and 7 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-081/15384026?
The CAS number of AO-081/15384026 is 347333-65-7.
What is the molecular formula of AO-081/15384026?
The molecular formula of AO-081/15384026 is C25H29N5O5.
What is the molecular weight of AO-081/15384026?
The molecular weight of AO-081/15384026 is 479.22 g/mol.
Where can I buy AO-081/15384026?
You can request a quote for AO-081/15384026 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AO-081/15384026?
Yes, KEHONG BIO provides custom synthesis services for AO-081/15384026 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.