BIM-0010436.P001
TL;DR: BIM-0010436.P001 (CAS 354770-55-1) is a chemical compound with molecular formula C22H21N3OS2 and molecular weight 407.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-2-(phenylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: BIM-0010436.P001, N-phenyl-2-(phenylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-phenyl-2-[(phenylcarbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-phenyl(2-{[(phenylamino)thioxomethyl]amino}(4,5,6,7-tetrahydrobenzo[b]thioph en-3-yl))carboxamide
| Molecular Formula | C22H21N3OS2 |
|---|---|
| Molecular Weight | 407.11 g/mol |
| LogP | 5.6881 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.1126 |
| Heavy Atoms | 28 |
| Complexity | 983.7763 |
Chemical Identifiers
| CAS Number | 354770-55-1 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=S)NC3=CC=CC=C3)C(=O)NC4=CC=CC=C4 |
Product Overview
BIM-0010436.P001 (CAS 354770-55-1), with molecular formula C22H21N3OS2 and molecular weight 407.11 g/mol. IUPAC: N-phenyl-2-(phenylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of BIM-0010436.P001
Property Insights of BIM-0010436.P001
The XLogP value of 5.6881 indicates that BIM-0010436.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.16 Ų, BIM-0010436.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0010436.P001 has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0010436.P001?
The CAS number of BIM-0010436.P001 is 354770-55-1.
What is the molecular formula of BIM-0010436.P001?
The molecular formula of BIM-0010436.P001 is C22H21N3OS2.
What is the molecular weight of BIM-0010436.P001?
The molecular weight of BIM-0010436.P001 is 407.11 g/mol.
Where can I buy BIM-0010436.P001?
You can request a quote for BIM-0010436.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0010436.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0010436.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.