1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane
TL;DR: 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane (CAS 63641-78-1) is a chemical compound with molecular formula C19H28N4O4 and molecular weight 376.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane
Also Known As: Piperazine, 2-methyl-, polymer with 1,3-diisocyanatomethylbenzene, methyloxirane and oxirane, (C9-H6-N2-O2.C5-H12-N2.C3-H6-O.C2-H4-O)x-, 1,3-diisocyanato-2-methylbenzene; 2-methyloxirane; 2-methylpiperazine; oxirane, Piperazine, 2-methyl-, polymer with 1,3-diisocyanatomethylbenzene, 2-methyloxirane and oxirane
| Molecular Formula | C19H28N4O4 |
|---|---|
| Molecular Weight | 376.21 g/mol |
| LogP | 1.91902 |
| Topological Polar Surface Area | 107.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.21106 |
| Heavy Atoms | 27 |
| Complexity | 604.1049 |
Chemical Identifiers
| CAS Number | 63641-78-1 |
|---|---|
| SMILES | CC1CNCCN1.CC1CO1.CC1=C(C=CC=C1N=C=O)N=C=O.C1CO1 |
Product Overview
1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane (CAS 63641-78-1), with molecular formula C19H28N4O4 and molecular weight 376.21 g/mol. IUPAC: 1,3-diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane.
Chemical Property Profile of 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane
Property Insights of 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane
The XLogP value of 1.91902 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane. The TPSA of 107.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane. Following Lipinski's Rule of Five, 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane has 2 hydrogen bond donor(s) and 8 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 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane?
The CAS number of 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane is 63641-78-1.
What is the molecular formula of 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane?
The molecular formula of 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane is C19H28N4O4.
What is the molecular weight of 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane?
The molecular weight of 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane is 376.21 g/mol.
Where can I buy 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane?
You can request a quote for 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diisocyanato-2-methylbenzene;2-methyloxirane;2-methylpiperazine;oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.