Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)-
TL;DR: Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)- (CAS 81827-54-5) is a chemical compound with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (13E)-13-ethylidene-4-hydroxy-8-methyl-8,15-diazapentacyclo[10.5.1.01,9.02,7.010,15]octadeca-2(7),3,5-triene-18-carboxylate
Also Known As: Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)-
| Molecular Formula | C21H26N2O3 |
|---|---|
| Molecular Weight | 354.19 g/mol |
| LogP | 2.2917 |
| Topological Polar Surface Area | 53.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 354.19434 |
| Heavy Atoms | 26 |
| Complexity | 819.47424 |
Chemical Identifiers
| CAS Number | 81827-54-5 |
|---|---|
| SMILES | C/C=C\1/CN2CCC34C(C1CC2C3N(C5=C4C=C(C=C5)O)C)C(=O)OC |
Product Overview
Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)- (CAS 81827-54-5), with molecular formula C21H26N2O3 and molecular weight 354.19 g/mol. IUPAC: methyl (13E)-13-ethylidene-4-hydroxy-8-methyl-8,15-diazapentacyclo[10.5.1.01,9.02,7.010,15]octadeca-2(7),3,5-triene-18-carboxylate.
Chemical Property Profile of Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)-
Property Insights of Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)-
The XLogP value of 2.2917 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)-. With a topological polar surface area (TPSA) of 53.01 Ų, Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)- has 1 hydrogen bond donor(s) and 5 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 Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)-?
The CAS number of Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)- is 81827-54-5.
What is the molecular formula of Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)-?
The molecular formula of Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)- is C21H26N2O3.
What is the molecular weight of Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)-?
The molecular weight of Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)- is 354.19 g/mol.
Where can I buy Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)-?
You can request a quote for Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)-?
Yes, KEHONG BIO provides custom synthesis services for Akuammilan-17-oic acid, 1,2-dihydro-10-hydroxy-1-methyl-, methyl ester, (2beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.