Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide
TL;DR: Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide (CAS 132235-85-9) is a chemical compound with molecular formula C22H25N5O5 and molecular weight 439.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8S,11S,14S)-11-benzyl-3,9,12-trioxo-1,4,10,13,17-pentazatricyclo[14.2.1.04,8]nonadeca-16(19),17-diene-14-carboxylic acid
Also Known As: Ccmpph, Cyclo(CM-pro-phe-his-NH2), Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide, 2',3'-dideoxy-3'-C-hydroxymethyl-cytosine, (8S,11S,14S)-11-benzyl-3,9,12-trioxo-1,4,10,13,17-pentazatricyclo[14.2.1.04,8]nonadeca-16(19),17-diene-14-carboxylic acid
| Molecular Formula | C22H25N5O5 |
|---|---|
| Molecular Weight | 439.19 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 439.18558 |
| Heavy Atoms | 32 |
| Complexity | 740.0 |
Chemical Identifiers
| CAS Number | 132235-85-9 |
|---|---|
| SMILES | C1C[C@H]2C(=O)N[C@H](C(=O)N[C@@H](CC3=CN(CC(=O)N2C1)C=N3)C(=O)O)CC4=CC=CC=C4 |
| InChIKey | BRDOIPUWLRDLHZ-BZSNNMDCSA-N |
Product Overview
Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide (CAS 132235-85-9), with molecular formula C22H25N5O5 and molecular weight 439.19 g/mol. IUPAC: (8S,11S,14S)-11-benzyl-3,9,12-trioxo-1,4,10,13,17-pentazatricyclo[14.2.1.04,8]nonadeca-16(19),17-diene-14-carboxylic acid.
Chemical Property Profile of Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide
Property Insights of Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide. Following Lipinski's Rule of Five, Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide has 3 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 Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide?
The CAS number of Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide is 132235-85-9.
What is the molecular formula of Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide?
The molecular formula of Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide is C22H25N5O5.
What is the molecular weight of Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide?
The molecular weight of Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide is 439.19 g/mol.
Where can I buy Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide?
You can request a quote for Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide?
Yes, KEHONG BIO provides custom synthesis services for Cyclic(3-1)-1-(carboxymethyl)prolyl-phenylalanyl-histidinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.