Igepan TC-42
TL;DR: Igepan TC-42 (CAS 433700-37-9) is a chemical compound with molecular formula C20H21N3O3S2 and molecular weight 415.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]benzamide
Also Known As: Igepan TC-42, AB00296378-02, F1102-0006, N-(3-hydroxypropyl){4-[(4-oxo(3,5,6,7-tetrahydrocyclopenta[1,2-d]pyrimidino[4, 5-b]thiophen-2-ylthio))methyl]phenyl}carboxamide, N-(3-hydroxypropyl)-4-(((4-oxo-4,5,6,7-tetrahydro-3H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)methyl)benzamide
| Molecular Formula | C20H21N3O3S2 |
|---|---|
| Molecular Weight | 415.10 g/mol |
| LogP | 2.8778 |
| Topological Polar Surface Area | 95.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.10245 |
| Heavy Atoms | 28 |
| Complexity | 1056.9834 |
Chemical Identifiers
| CAS Number | 433700-37-9 |
|---|---|
| SMILES | C1CC2=C(C1)SC3=C2C(=O)NC(=N3)SCC4=CC=C(C=C4)C(=O)NCCCO |
Product Overview
Igepan TC-42 (CAS 433700-37-9), with molecular formula C20H21N3O3S2 and molecular weight 415.10 g/mol. IUPAC: N-(3-hydroxypropyl)-4-[(12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl)sulfanylmethyl]benzamide.
Chemical Property Profile of Igepan TC-42
Property Insights of Igepan TC-42
The XLogP value of 2.8778 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Igepan TC-42. The TPSA of 95.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Igepan TC-42. Following Lipinski's Rule of Five, Igepan TC-42 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 Igepan TC-42?
The CAS number of Igepan TC-42 is 433700-37-9.
What is the molecular formula of Igepan TC-42?
The molecular formula of Igepan TC-42 is C20H21N3O3S2.
What is the molecular weight of Igepan TC-42?
The molecular weight of Igepan TC-42 is 415.10 g/mol.
Where can I buy Igepan TC-42?
You can request a quote for Igepan TC-42 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Igepan TC-42?
Yes, KEHONG BIO provides custom synthesis services for Igepan TC-42 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.