2-Benzothiazolecarbothioamide, N-phenyl-
TL;DR: 2-Benzothiazolecarbothioamide, N-phenyl- (CAS 61349-98-2) is a chemical compound with molecular formula C14H10N2S2 and molecular weight 270.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-1,3-benzothiazole-2-carbothioamide
Also Known As: 2-Benzothiazolecarbothioamide, N-phenyl-, N-phenyl-1,3-benzothiazole-2-carbothioamide, N-phenylbenzthiazole-2-carbothioamide, Benzothiazol-2-thiocarbonsaeure-anilid, N-phenylbenzo[d]thiazole-2-carbothioamide
| Molecular Formula | C14H10N2S2 |
|---|---|
| Molecular Weight | 270.03 g/mol |
| LogP | 4.0839 |
| Topological Polar Surface Area | 24.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.02853 |
| Heavy Atoms | 18 |
| Complexity | 656.0952 |
Chemical Identifiers
| CAS Number | 61349-98-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=S)C2=NC3=CC=CC=C3S2 |
Product Overview
2-Benzothiazolecarbothioamide, N-phenyl- (CAS 61349-98-2), with molecular formula C14H10N2S2 and molecular weight 270.03 g/mol. IUPAC: N-phenyl-1,3-benzothiazole-2-carbothioamide.
Chemical Property Profile of 2-Benzothiazolecarbothioamide, N-phenyl-
Property Insights of 2-Benzothiazolecarbothioamide, N-phenyl-
The XLogP value of 4.0839 indicates that 2-Benzothiazolecarbothioamide, N-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.92 Ų, 2-Benzothiazolecarbothioamide, N-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzothiazolecarbothioamide, N-phenyl- has 1 hydrogen bond donor(s) and 3 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 2-Benzothiazolecarbothioamide, N-phenyl-?
The CAS number of 2-Benzothiazolecarbothioamide, N-phenyl- is 61349-98-2.
What is the molecular formula of 2-Benzothiazolecarbothioamide, N-phenyl-?
The molecular formula of 2-Benzothiazolecarbothioamide, N-phenyl- is C14H10N2S2.
What is the molecular weight of 2-Benzothiazolecarbothioamide, N-phenyl-?
The molecular weight of 2-Benzothiazolecarbothioamide, N-phenyl- is 270.03 g/mol.
Where can I buy 2-Benzothiazolecarbothioamide, N-phenyl-?
You can request a quote for 2-Benzothiazolecarbothioamide, N-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzothiazolecarbothioamide, N-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzothiazolecarbothioamide, N-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.