3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione
TL;DR: 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione (CAS 618072-96-1) is a chemical compound with molecular formula C14H14N4S2 and molecular weight 302.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-(1-methylbenzimidazol-2-yl)-3-prop-2-enyl-1,3-thiazole-2-thione
Also Known As: ChemDiv2_001470, 3-allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-yl)-1,3-thiazole-2(3H)-thione, 4-amino-5-(1-methylbenzimidazol-2-yl)-3-prop-2-enyl-1,3-thiazole-2-thione, 3-Allyl-4-amino-5-(1-methyl-1H-benzo[d]imidazol-2-yl)thiazole-2(3H)-thione, 4-amino-5-(1-methyl-1H-benzimidazol-2-yl)-3-(prop-2-en-1-yl)-1,3-thiazole-2(3H)-thione
| Molecular Formula | C14H14N4S2 |
|---|---|
| Molecular Weight | 302.07 g/mol |
| LogP | 3.60099 |
| Topological Polar Surface Area | 48.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.06598 |
| Heavy Atoms | 20 |
| Complexity | 853.8017 |
Chemical Identifiers
| CAS Number | 618072-96-1 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1C3=C(N(C(=S)S3)CC=C)N |
Product Overview
3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione (CAS 618072-96-1), with molecular formula C14H14N4S2 and molecular weight 302.07 g/mol. IUPAC: 4-amino-5-(1-methylbenzimidazol-2-yl)-3-prop-2-enyl-1,3-thiazole-2-thione.
Chemical Property Profile of 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione
Property Insights of 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione
The XLogP value of 3.60099 indicates that 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.77 Ų, 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione has 1 hydrogen bond donor(s) and 4 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 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione?
The CAS number of 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione is 618072-96-1.
What is the molecular formula of 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione?
The molecular formula of 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione is C14H14N4S2.
What is the molecular weight of 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione?
The molecular weight of 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione is 302.07 g/mol.
Where can I buy 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione?
You can request a quote for 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-Allyl-4-amino-5-(1-methyl-1H-benzimidazol-2-YL)-1,3-thiazole-2(3H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.