A2268/0095571
TL;DR: A2268/0095571 (CAS 295313-74-5) is a chemical compound with molecular formula C21H20N2O5 and molecular weight 380.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl (1R,9R)-14-amino-15-cyano-11-methyl-8-oxo-12,13-dioxatetracyclo[7.3.3.01,9.02,7]pentadeca-2,4,6,10,14-pentaene-10-carboxylate
Also Known As: A2268/0095571, pentyl (3aR,8bR)-10-amino-11-cyano-2-methyl-4-oxo-4H-8b,3a-(epoxyetheno)indeno[1,2-b]furan-3-carboxylate, 1-oxo-2,3(bis[3-oxa-1-propeno])-2'-amino-1'-cyano-1''-carboxypentanoindane, (3aR,8bR)-pentyl 10-amino-11-cyano-2-methyl-4-oxo-4H-8b,3a-(epoxyetheno)indeno[1,2-b]furan-3-carboxylate, PENTYL (1R,9R)-14-AMINO-15-CYANO-11-METHYL-8-OXO-12,13-DIOXATETRACYCLO[7.3.3.0(1),?.0(2),?]PENTADECA-2(7),3,5,10,14-PENTAENE-10-CARBOXYLATE
| Molecular Formula | C21H20N2O5 |
|---|---|
| Molecular Weight | 380.14 g/mol |
| LogP | 2.78378 |
| Topological Polar Surface Area | 111.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.1372 |
| Heavy Atoms | 28 |
| Complexity | 1002.29346 |
Chemical Identifiers
| CAS Number | 295313-74-5 |
|---|---|
| SMILES | CCCCCOC(=O)C1=C(O[C@@]23[C@@]1(C(=C(O2)N)C#N)C(=O)C4=CC=CC=C34)C |
Product Overview
A2268/0095571 (CAS 295313-74-5), with molecular formula C21H20N2O5 and molecular weight 380.14 g/mol. IUPAC: pentyl (1R,9R)-14-amino-15-cyano-11-methyl-8-oxo-12,13-dioxatetracyclo[7.3.3.01,9.02,7]pentadeca-2,4,6,10,14-pentaene-10-carboxylate.
Chemical Property Profile of A2268/0095571
Property Insights of A2268/0095571
The XLogP value of 2.78378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2268/0095571. The TPSA of 111.64 Ų falls within the moderate polarity range, balancing permeability and solubility for A2268/0095571. Following Lipinski's Rule of Five, A2268/0095571 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 A2268/0095571?
The CAS number of A2268/0095571 is 295313-74-5.
What is the molecular formula of A2268/0095571?
The molecular formula of A2268/0095571 is C21H20N2O5.
What is the molecular weight of A2268/0095571?
The molecular weight of A2268/0095571 is 380.14 g/mol.
Where can I buy A2268/0095571?
You can request a quote for A2268/0095571 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2268/0095571?
Yes, KEHONG BIO provides custom synthesis services for A2268/0095571 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.