PEPTC
TL;DR: PEPTC (CAS 67075-37-0) is a chemical compound with molecular formula C40H26N2O4 and molecular weight 598.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,18-bis(2-phenylethyl)-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone
Also Known As: PEPTC, Black S 0084, Paliogen Black L-0084, Paliogen Black S-0084, C.I. Pigment Black 31
| Molecular Formula | C40H26N2O4 |
|---|---|
| Molecular Weight | 598.19 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 598.1893 |
| Heavy Atoms | 46 |
| Complexity | 1070.0 |
Chemical Identifiers
| CAS Number | 67075-37-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCN2C(=O)C3=C4C(=CC=C5C4=C(C=C3)C6=C7C5=CC=C8C7=C(C=C6)C(=O)N(C8=O)CCC9=CC=CC=C9)C2=O |
| InChIKey | IIKSFQIOFHBWSO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
PEPTC (CAS 67075-37-0), with molecular formula C40H26N2O4 and molecular weight 598.19 g/mol. IUPAC: 7,18-bis(2-phenylethyl)-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone.
Chemical Property Profile of PEPTC
Property Insights of PEPTC
The XLogP value of 7.6 indicates that PEPTC is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for PEPTC. Following Lipinski's Rule of Five, PEPTC has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of PEPTC?
The CAS number of PEPTC is 67075-37-0.
What is the molecular formula of PEPTC?
The molecular formula of PEPTC is C40H26N2O4.
What is the molecular weight of PEPTC?
The molecular weight of PEPTC is 598.19 g/mol.
Where can I buy PEPTC?
You can request a quote for PEPTC directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PEPTC?
Yes, KEHONG BIO provides custom synthesis services for PEPTC and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.