2,4-TDI-BIS-1,2MP
TL;DR: 2,4-TDI-BIS-1,2MP (CAS 190653-33-9) is a chemical compound with molecular formula C31H38N6O4 and molecular weight 558.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-methoxyphenyl)-N-[3-[[4-(2-methoxyphenyl)piperazine-1-carbonyl]amino]-4-methylphenyl]piperazine-1-carboxamide
Also Known As: 2,4-TDI-BIS-1,2MP, 2,4-Toluenediisocyanate-MOPP-adduct, 4-(2-methoxyphenyl)-N-[3-[[4-(2-methoxyphenyl)piperazine-1-carbonyl]amino]-4-methylphenyl]piperazine-1-carboxamide, [4-(2-methoxyphenyl)piperazinyl]-N-(5-{[4-(2-methoxyphenyl)piperazinyl]carbony lamino}-2-methylphenyl)carboxamide
| Molecular Formula | C31H38N6O4 |
|---|---|
| Molecular Weight | 558.30 g/mol |
| LogP | 4.72042 |
| Topological Polar Surface Area | 89.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 558.2955 |
| Heavy Atoms | 41 |
| Complexity | 1366.219 |
Chemical Identifiers
| CAS Number | 190653-33-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC=C3OC)NC(=O)N4CCN(CC4)C5=CC=CC=C5OC |
Product Overview
2,4-TDI-BIS-1,2MP (CAS 190653-33-9), with molecular formula C31H38N6O4 and molecular weight 558.30 g/mol. IUPAC: 4-(2-methoxyphenyl)-N-[3-[[4-(2-methoxyphenyl)piperazine-1-carbonyl]amino]-4-methylphenyl]piperazine-1-carboxamide.
Chemical Property Profile of 2,4-TDI-BIS-1,2MP
Property Insights of 2,4-TDI-BIS-1,2MP
The XLogP value of 4.72042 indicates that 2,4-TDI-BIS-1,2MP is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-TDI-BIS-1,2MP. Following Lipinski's Rule of Five, 2,4-TDI-BIS-1,2MP has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4-TDI-BIS-1,2MP?
The CAS number of 2,4-TDI-BIS-1,2MP is 190653-33-9.
What is the molecular formula of 2,4-TDI-BIS-1,2MP?
The molecular formula of 2,4-TDI-BIS-1,2MP is C31H38N6O4.
What is the molecular weight of 2,4-TDI-BIS-1,2MP?
The molecular weight of 2,4-TDI-BIS-1,2MP is 558.30 g/mol.
Where can I buy 2,4-TDI-BIS-1,2MP?
You can request a quote for 2,4-TDI-BIS-1,2MP directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-TDI-BIS-1,2MP?
Yes, KEHONG BIO provides custom synthesis services for 2,4-TDI-BIS-1,2MP and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.