Cyclo(methyltauryl-phenylalanyl-proline)
TL;DR: Cyclo(methyltauryl-phenylalanyl-proline) (CAS 126370-66-9) is a chemical compound with molecular formula C17H23N3O4S and molecular weight 365.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7S,12aR)-7-benzyl-2-methyl-5,5-dioxo-3,4,6,7,10,11,12,12a-octahydropyrrolo[1,2-e][1,2,5,8]thiatriazecine-1,8-dione
Also Known As: Cyclo(metau-phe-pro), Cyclo(-Me-tau-phe-pro-), Cyclo(methyltauryl-phenylalanyl-proline), PROTEIN KINASE INHIBITOR,cAMP-Dependent, (7S,12aR)-7-benzyl-2-methyl-5,5-dioxo-3,4,6,7,10,11,12,12a-octahydropyrrolo[1,2-e][1,2,5,8]thiatriazecine-1,8-dione
| Molecular Formula | C17H23N3O4S |
|---|---|
| Molecular Weight | 365.14 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 365.14093 |
| Heavy Atoms | 25 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 126370-66-9 |
|---|---|
| SMILES | CN1CCS(=O)(=O)N[C@H](C(=O)N2CCC[C@@H]2C1=O)CC3=CC=CC=C3 |
| InChIKey | HNKPSCFTSSIEQN-LSDHHAIUSA-N |
Product Overview
Cyclo(methyltauryl-phenylalanyl-proline) (CAS 126370-66-9), with molecular formula C17H23N3O4S and molecular weight 365.14 g/mol. IUPAC: (7S,12aR)-7-benzyl-2-methyl-5,5-dioxo-3,4,6,7,10,11,12,12a-octahydropyrrolo[1,2-e][1,2,5,8]thiatriazecine-1,8-dione.
Chemical Property Profile of Cyclo(methyltauryl-phenylalanyl-proline)
Property Insights of Cyclo(methyltauryl-phenylalanyl-proline)
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclo(methyltauryl-phenylalanyl-proline). The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclo(methyltauryl-phenylalanyl-proline). Following Lipinski's Rule of Five, Cyclo(methyltauryl-phenylalanyl-proline) 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 Cyclo(methyltauryl-phenylalanyl-proline)?
The CAS number of Cyclo(methyltauryl-phenylalanyl-proline) is 126370-66-9.
What is the molecular formula of Cyclo(methyltauryl-phenylalanyl-proline)?
The molecular formula of Cyclo(methyltauryl-phenylalanyl-proline) is C17H23N3O4S.
What is the molecular weight of Cyclo(methyltauryl-phenylalanyl-proline)?
The molecular weight of Cyclo(methyltauryl-phenylalanyl-proline) is 365.14 g/mol.
Where can I buy Cyclo(methyltauryl-phenylalanyl-proline)?
You can request a quote for Cyclo(methyltauryl-phenylalanyl-proline) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclo(methyltauryl-phenylalanyl-proline)?
Yes, KEHONG BIO provides custom synthesis services for Cyclo(methyltauryl-phenylalanyl-proline) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.