Kobutimycin A
TL;DR: Kobutimycin A (CAS 145458-91-9) is a chemical compound with molecular formula C19H25NO5 and molecular weight 347.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1Z)-3-acetyloxy-1-(8-methyl-2-oxa-6-azatricyclo[5.3.0.01,3]deca-6,8-dien-10-ylidene)butan-2-yl] 2-methylpropanoate
Also Known As: Kobutimycin A, 5-Methyl-7-(2'-(2''-methylpropionyloxy)-3'-acetoxy)butylidene-1a,2,3,7-tetrahydrocyclopent(b)oxireno(c)pyridine, [(1Z)-3-acetyloxy-1-(8-methyl-2-oxa-6-azatricyclo[5.3.0.01,3]deca-6,8-dien-10-ylidene)butan-2-yl] 2-methylpropanoate, Propanoic acid, 2-methyl-, 2-(acetyloxy)-1-((2,3-dihydro-5-methylcyclopent(b)oxireno(c)pyridin-7(1aH)-ylidene)methyl)propyl ester, (Z)-(+)-, ((1Z)-3-acetyloxy-1-(8-methyl-2-oxa-6-azatricyclo(5.3.0.01,3)deca-6,8-dien-10-ylidene)butan-2-yl) 2-methylpropanoate
| Molecular Formula | C19H25NO5 |
|---|---|
| Molecular Weight | 347.17 g/mol |
| LogP | 2.3744 |
| Topological Polar Surface Area | 77.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.17328 |
| Heavy Atoms | 25 |
| Complexity | 689.92804 |
Chemical Identifiers
| CAS Number | 145458-91-9 |
|---|---|
| SMILES | CC1=C/C(=C/C(C(C)OC(=O)C)OC(=O)C(C)C)/C23C1=NCCC2O3 |
Product Overview
Kobutimycin A (CAS 145458-91-9), with molecular formula C19H25NO5 and molecular weight 347.17 g/mol. IUPAC: [(1Z)-3-acetyloxy-1-(8-methyl-2-oxa-6-azatricyclo[5.3.0.01,3]deca-6,8-dien-10-ylidene)butan-2-yl] 2-methylpropanoate.
Chemical Property Profile of Kobutimycin A
Property Insights of Kobutimycin A
The XLogP value of 2.3744 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Kobutimycin A. The TPSA of 77.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Kobutimycin A. Following Lipinski's Rule of Five, Kobutimycin A has 0 hydrogen bond donor(s) and 6 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 Kobutimycin A?
The CAS number of Kobutimycin A is 145458-91-9.
What is the molecular formula of Kobutimycin A?
The molecular formula of Kobutimycin A is C19H25NO5.
What is the molecular weight of Kobutimycin A?
The molecular weight of Kobutimycin A is 347.17 g/mol.
Where can I buy Kobutimycin A?
You can request a quote for Kobutimycin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Kobutimycin A?
Yes, KEHONG BIO provides custom synthesis services for Kobutimycin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.