RefChem:127910
TL;DR: RefChem:127910 (CAS 67828-07-3) is a chemical compound with molecular formula C38H32CuN12O3 and molecular weight 767.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
copper;2-hydroxyacetic acid;[14,17,35-tris(aminomethyl)-2,11,20,29,39,40-hexaza-37,38-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1(36),2,4,6,8,10(40),11,13,15,17,19(39),20,22,24,26,28,30,32,34-nonadecaen-5-yl]methanamine
Also Known As: (29H,31H-Phthalocyaninetetramethylaminato(2-)-N29,N30,N31,N32)copper tetrakis(hydroxyacetate), (29H,31H-Phthalocyaninetetramethanaminato(2-)-N29,N30,N31,N32)copper, glycolic acid salt (1:4), [29H,31H-Phthalocyaninetetramethylaminato(2-)-N29,N30,N31,N32]copper tetrakis(hydroxyacetate), Copper, (29H,31H-phthalocyanine-C,C,C,C-tetramethanaminato(2-)-kappaN29,kappaN30,kappaN31,kappaN32)-, 2-hydroxyacetate (1:4), Copper, (29H,31H-phthalocyanine-C,C,C,C-tetramethanaminato(2-)-kappaN29,kappaN30,kappaN31,kappaN32)-, tetrakis(hydroxyacetate)
| Molecular Formula | C38H32CuN12O3 |
|---|---|
| Molecular Weight | 767.20 g/mol |
| LogP | 3.023 |
| Topological Polar Surface Area | 241.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 5 |
| Exact Mass | 767.20166 |
| Heavy Atoms | 54 |
| Complexity | 1150.0 |
Chemical Identifiers
| CAS Number | 67828-07-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=NC4=C5C=CC=C(C5=C([N-]4)N=C6C7=C(C=CC=C7C(=N6)N=C8C9=C(C=CC(=C9C(=N8)N=C2[N-]3)CN)CN)CN)CN.C(C(=O)O)O.[Cu+2] |
| InChIKey | ODYVYNTYKDJSMS-UHFFFAOYSA-N |
Product Overview
RefChem:127910 (CAS 67828-07-3), with molecular formula C38H32CuN12O3 and molecular weight 767.20 g/mol. IUPAC: copper;2-hydroxyacetic acid;[14,17,35-tris(aminomethyl)-2,11,20,29,39,40-hexaza-37,38-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1(36),2,4,6,8,10(40),11,13,15,17,19(39),20,22,24,26,28,30,32,34-nonadecaen-5-yl]methanamine.
Chemical Property Profile of RefChem:127910
Property Insights of RefChem:127910
The XLogP value of 3.023 indicates that RefChem:127910 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 241.0 Ų indicates high polarity, suggesting RefChem:127910 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:127910 has 6 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:127910?
The CAS number of RefChem:127910 is 67828-07-3.
What is the molecular formula of RefChem:127910?
The molecular formula of RefChem:127910 is C38H32CuN12O3.
What is the molecular weight of RefChem:127910?
The molecular weight of RefChem:127910 is 767.20 g/mol.
Where can I buy RefChem:127910?
You can request a quote for RefChem:127910 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:127910?
Yes, KEHONG BIO provides custom synthesis services for RefChem:127910 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.