Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate
TL;DR: Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate (CAS 87168-88-5) is a chemical compound with molecular formula C15H23N3O4 and molecular weight 309.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl N-(4-methylanilino)-N-(propan-2-yloxycarbonylamino)carbamate
Also Known As: Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate, Diisopropyl 3-(4-methylphenyl)triazane-1,2-dicarboxylate, Di(propan-2-yl) 3-(4-methylphenyl)triazane-1,2-dicarboxylate, propan-2-yl N-(4-methylanilino)-N-(propan-2-yloxycarbonylami, isopropyl N-(isopropoxycarbonylamino)-N-(4-methylanilino)carbamate
| Molecular Formula | C15H23N3O4 |
|---|---|
| Molecular Weight | 309.17 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 79.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 309.16885 |
| Heavy Atoms | 22 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 87168-88-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NN(C(=O)OC(C)C)NC(=O)OC(C)C |
| InChIKey | RWJMJUMYPBUIQA-UHFFFAOYSA-N |
Product Overview
Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate (CAS 87168-88-5), with molecular formula C15H23N3O4 and molecular weight 309.17 g/mol. IUPAC: propan-2-yl N-(4-methylanilino)-N-(propan-2-yloxycarbonylamino)carbamate.
Chemical Property Profile of Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate
Property Insights of Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate
The XLogP value of 4.4 indicates that Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate. Following Lipinski's Rule of Five, Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate has 2 hydrogen bond donor(s) and 5 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 Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate?
The CAS number of Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate is 87168-88-5.
What is the molecular formula of Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate?
The molecular formula of Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate is C15H23N3O4.
What is the molecular weight of Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate?
The molecular weight of Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate is 309.17 g/mol.
Where can I buy Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate?
You can request a quote for Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dipropan-2-yl 3-(4-methylphenyl)triazane-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.