![N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide structure](/static/products/4256/425657-20-1.webp)
N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide
TL;DR: N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide (CAS 425657-20-1) is a chemical compound with molecular formula C19H12ClN3O2S2 and molecular weight 413.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide
Also Known As: AB00105481-01, N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide, N-({[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]amino}carbonothioyl)thiophene-2-carboxamide, N-[(5-benzooxazol-2-yl-2-chloro-phenyl)thiocarbamoyl]thiophene-2-carboxamide, N-{[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl}thiophene-2-carboxamide
| Molecular Formula | C19H12ClN3O2S2 |
|---|---|
| Molecular Weight | 413.01 g/mol |
| LogP | 5.3365 |
| Topological Polar Surface Area | 67.16 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 413.00595 |
| Heavy Atoms | 27 |
| Complexity | 1106.0408 |
Chemical Identifiers
| CAS Number | 425657-20-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)C3=CC(=C(C=C3)Cl)NC(=S)NC(=O)C4=CC=CS4 |
Product Overview
N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide (CAS 425657-20-1), with molecular formula C19H12ClN3O2S2 and molecular weight 413.01 g/mol. IUPAC: N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide.
Chemical Property Profile of N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide
Property Insights of N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide
The XLogP value of 5.3365 indicates that N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.16 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide. Following Lipinski's Rule of Five, N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide?
The CAS number of N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide is 425657-20-1.
What is the molecular formula of N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide?
The molecular formula of N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide is C19H12ClN3O2S2.
What is the molecular weight of N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide?
The molecular weight of N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide is 413.01 g/mol.
Where can I buy N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide?
You can request a quote for N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]thiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.