BIM-0042770.P001
TL;DR: BIM-0042770.P001 (CAS 314289-86-6) is a chemical compound with molecular formula C28H24F2N4S2 and molecular weight 518.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-1-[2-[N-[(4-fluorophenyl)carbamothioyl]anilino]ethyl]-1-phenylthiourea
Also Known As: BIM-0042770.P001, 1,1'-ethane-1,2-diylbis[3-(4-fluorophenyl)-1-phenyl(thiourea)], 3-(4-fluorophenyl)-1-[2-[N-[(4-fluorophenyl)carbamothioyl]anilino]ethyl]-1-phenylthiourea, N,N''-1,2-ethanediylbis[N'-(4-fluorophenyl)-N-phenyl(thiourea)]
| Molecular Formula | C28H24F2N4S2 |
|---|---|
| Molecular Weight | 518.14 g/mol |
| LogP | 7.0718 |
| Topological Polar Surface Area | 30.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 518.14105 |
| Heavy Atoms | 36 |
| Complexity | 1181.9606 |
Chemical Identifiers
| CAS Number | 314289-86-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(CCN(C2=CC=CC=C2)C(=S)NC3=CC=C(C=C3)F)C(=S)NC4=CC=C(C=C4)F |
Product Overview
BIM-0042770.P001 (CAS 314289-86-6), with molecular formula C28H24F2N4S2 and molecular weight 518.14 g/mol. IUPAC: 3-(4-fluorophenyl)-1-[2-[N-[(4-fluorophenyl)carbamothioyl]anilino]ethyl]-1-phenylthiourea.
Chemical Property Profile of BIM-0042770.P001
Property Insights of BIM-0042770.P001
The XLogP value of 7.0718 indicates that BIM-0042770.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.54 Ų, BIM-0042770.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0042770.P001 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 BIM-0042770.P001?
The CAS number of BIM-0042770.P001 is 314289-86-6.
What is the molecular formula of BIM-0042770.P001?
The molecular formula of BIM-0042770.P001 is C28H24F2N4S2.
What is the molecular weight of BIM-0042770.P001?
The molecular weight of BIM-0042770.P001 is 518.14 g/mol.
Where can I buy BIM-0042770.P001?
You can request a quote for BIM-0042770.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042770.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042770.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.