3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione
TL;DR: 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione (CAS 105687-44-3) is a chemical compound with molecular formula C16H14N2S2 and molecular weight 298.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzylamino)-4-phenyl-1,3-thiazole-2-thione
Also Known As: 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione, 3-(Benzylamino)-4-phenylthiazole-2(3H)-thione, 3-(benzylamino)-4-phenyl-1,3-thiazole-2-thione, 3-(benzylamino)-4-phenyl-thiazole-2-thione
| Molecular Formula | C16H14N2S2 |
|---|---|
| Molecular Weight | 298.06 g/mol |
| LogP | 4.68979 |
| Topological Polar Surface Area | 16.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.05984 |
| Heavy Atoms | 20 |
| Complexity | 729.9283 |
Chemical Identifiers
| CAS Number | 105687-44-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNN2C(=CSC2=S)C3=CC=CC=C3 |
Product Overview
3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione (CAS 105687-44-3), with molecular formula C16H14N2S2 and molecular weight 298.06 g/mol. IUPAC: 3-(benzylamino)-4-phenyl-1,3-thiazole-2-thione.
Chemical Property Profile of 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione
Property Insights of 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione
The XLogP value of 4.68979 indicates that 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 16.96 Ų, 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione 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 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione?
The CAS number of 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione is 105687-44-3.
What is the molecular formula of 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione?
The molecular formula of 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione is C16H14N2S2.
What is the molecular weight of 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione?
The molecular weight of 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione is 298.06 g/mol.
Where can I buy 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione?
You can request a quote for 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-(Benzylamino)-4-phenyl-2,3-dihydro-1,3-thiazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.