U-62736
TL;DR: U-62736 (CAS 89553-54-8) is a chemical compound with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-10-methylsulfonyl-5,10-diazatetracyclo[7.4.0.01,12.02,6]trideca-2(6),3,8-trien-7-one
Also Known As: U-62736, U 62736, Oleic acid, compound with tributylamine (1:1), 7-Methyl-2-(methylsulfonyl)1,2,8,8a-tetrahydro-cyclopropa(c)pyrrolo(3,2-e)indol-4(5H)-one, Cyclopropa(c)pyrrolo(3,2-e)indol-4(5H)-one, 1,2,8,8a-tetrahydro-7-methyl-2-(methylsulfonyl)-
| Molecular Formula | C13H14N2O3S |
|---|---|
| Molecular Weight | 278.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 78.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.0725 |
| Heavy Atoms | 19 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 89553-54-8 |
|---|---|
| SMILES | CC1=CNC2=C1C34CC3CN(C4=CC2=O)S(=O)(=O)C |
| InChIKey | KYNKYZUQDFXAGD-UHFFFAOYSA-N |
Product Overview
U-62736 (CAS 89553-54-8), with molecular formula C13H14N2O3S and molecular weight 278.07 g/mol. IUPAC: 3-methyl-10-methylsulfonyl-5,10-diazatetracyclo[7.4.0.01,12.02,6]trideca-2(6),3,8-trien-7-one.
Chemical Property Profile of U-62736
Property Insights of U-62736
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for U-62736. The TPSA of 78.6 Ų falls within the moderate polarity range, balancing permeability and solubility for U-62736. Following Lipinski's Rule of Five, U-62736 has 1 hydrogen bond donor(s) and 4 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 U-62736?
The CAS number of U-62736 is 89553-54-8.
What is the molecular formula of U-62736?
The molecular formula of U-62736 is C13H14N2O3S.
What is the molecular weight of U-62736?
The molecular weight of U-62736 is 278.07 g/mol.
Where can I buy U-62736?
You can request a quote for U-62736 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for U-62736?
Yes, KEHONG BIO provides custom synthesis services for U-62736 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.