(2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide
TL;DR: (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide (CAS 73902-87-1) is a chemical compound with molecular formula C9H10N4S2 and molecular weight 238.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]thiourea
Also Known As: [(E)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]thiourea|(2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide|(E)-2-(3-methylbenzo[d]thiazol-2(3H)-ylidene)hydrazinecarbothioamide
| Molecular Formula | C9H10N4S2 |
|---|---|
| Molecular Weight | 238.03 g/mol |
| LogP | 0.8887 |
| Topological Polar Surface Area | 55.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 238.03468 |
| Heavy Atoms | 15 |
| Complexity | 566.7412 |
Chemical Identifiers
| CAS Number | 73902-87-1 |
|---|---|
| SMILES | CN\1C2=CC=CC=C2S/C1=N/NC(=S)N |
Product Overview
(2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide (CAS 73902-87-1), with molecular formula C9H10N4S2 and molecular weight 238.03 g/mol. IUPAC: [(E)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]thiourea.
Chemical Property Profile of (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide
Property Insights of (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide
The XLogP value of 0.8887 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide. With a topological polar surface area (TPSA) of 55.34 Ų, (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide has 2 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 (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide?
The CAS number of (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide is 73902-87-1.
What is the molecular formula of (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide?
The molecular formula of (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide is C9H10N4S2.
What is the molecular weight of (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide?
The molecular weight of (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide is 238.03 g/mol.
Where can I buy (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide?
You can request a quote for (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.