3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea)
TL;DR: 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea) (CAS 43180-97-8) is a chemical compound with molecular formula C21H36N4O2 and molecular weight 376.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-[di(propan-2-yl)carbamoylamino]-4-methylphenyl]-1,1-di(propan-2-yl)urea
Also Known As: 3,3'-(4-METHYL-1,3-PHENYLENE)BIS(1,1-DIISOPROPYLUREA), 1-(5-{[bis(propan-2-yl)carbamoyl]amino}-2-methylphenyl)-3,3-bis(propan-2-yl)urea, 3-[3-[di(propan-2-yl)carbamoylamino]-4-methylphenyl]-1,1-di(propan-2-yl)urea, 3-[5-(dipropan-2-ylcarbamoylamino)-2-methyl-phenyl]-1,1-dipropan-2-yl-urea
| Molecular Formula | C21H36N4O2 |
|---|---|
| Molecular Weight | 376.28 g/mol |
| LogP | 5.29642 |
| Topological Polar Surface Area | 64.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 376.2838 |
| Heavy Atoms | 27 |
| Complexity | 637.5817 |
Chemical Identifiers
| CAS Number | 43180-97-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)N(C(C)C)C(C)C)NC(=O)N(C(C)C)C(C)C |
Product Overview
3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea) (CAS 43180-97-8), with molecular formula C21H36N4O2 and molecular weight 376.28 g/mol. IUPAC: 3-[3-[di(propan-2-yl)carbamoylamino]-4-methylphenyl]-1,1-di(propan-2-yl)urea.
Chemical Property Profile of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea)
Property Insights of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea)
The XLogP value of 5.29642 indicates that 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea). Following Lipinski's Rule of Five, 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea) has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea)?
The CAS number of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea) is 43180-97-8.
What is the molecular formula of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea)?
The molecular formula of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea) is C21H36N4O2.
What is the molecular weight of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea)?
The molecular weight of 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea) is 376.28 g/mol.
Where can I buy 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea)?
You can request a quote for 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-(4-Methyl-1,3-phenylene)bis(1,1-diisopropylurea) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.