1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea
TL;DR: 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea (CAS 300799-97-7) is a chemical compound with molecular formula C11H13Cl3IN3O and molecular weight 434.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-dimethyl-3-[2,2,2-trichloro-1-(4-iodoanilino)ethyl]urea
Also Known As: BAS 00103154, 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea, 1,1-dimethyl-3-[2,2,2-trichloro-1-(4-iodoanilino)ethyl]urea, N,N-Dimethyl-N'-[2,2,2-trichloro-1-(4-iodoanilino)ethyl]urea #, 1,1-Dimethyl-3-[2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl]-urea
| Molecular Formula | C11H13Cl3IN3O |
|---|---|
| Molecular Weight | 434.92 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 44.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 434.9169 |
| Heavy Atoms | 19 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 300799-97-7 |
|---|---|
| SMILES | CN(C)C(=O)NC(C(Cl)(Cl)Cl)NC1=CC=C(C=C1)I |
| InChIKey | AGZFVIIRGDFLJB-UHFFFAOYSA-N |
Product Overview
1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea (CAS 300799-97-7), with molecular formula C11H13Cl3IN3O and molecular weight 434.92 g/mol. IUPAC: 1,1-dimethyl-3-[2,2,2-trichloro-1-(4-iodoanilino)ethyl]urea.
Chemical Property Profile of 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea
Property Insights of 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea
The XLogP value of 4.4 indicates that 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.4 Ų, 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea has 2 hydrogen bond donor(s) and 2 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 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea?
The CAS number of 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea is 300799-97-7.
What is the molecular formula of 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea?
The molecular formula of 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea is C11H13Cl3IN3O.
What is the molecular weight of 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea?
The molecular weight of 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea is 434.92 g/mol.
Where can I buy 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea?
You can request a quote for 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dimethyl-3-(2,2,2-trichloro-1-(4-iodo-phenylamino)-ethyl)-urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.