1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea
TL;DR: 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea (CAS 701950-87-0) is a chemical compound with molecular formula C14H13Cl2N3S2 and molecular weight 356.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea
Also Known As: 1-(2,3-dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea, [(2,3-dichlorophenyl)amino](4,5,6,7-tetrahydrobenzothiazol-2-ylamino)methane-1 -thione
| Molecular Formula | C14H13Cl2N3S2 |
|---|---|
| Molecular Weight | 356.99 g/mol |
| LogP | 5.1376 |
| Topological Polar Surface Area | 36.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 356.9928 |
| Heavy Atoms | 21 |
| Complexity | 661.3538 |
Chemical Identifiers
| CAS Number | 701950-87-0 |
|---|---|
| SMILES | C1CCC2=C(C1)N=C(S2)NC(=S)NC3=C(C(=CC=C3)Cl)Cl |
Product Overview
1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea (CAS 701950-87-0), with molecular formula C14H13Cl2N3S2 and molecular weight 356.99 g/mol. IUPAC: 1-(2,3-dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea.
Chemical Property Profile of 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea
Property Insights of 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea
The XLogP value of 5.1376 indicates that 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.95 Ų, 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea?
The CAS number of 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea is 701950-87-0.
What is the molecular formula of 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea?
The molecular formula of 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea is C14H13Cl2N3S2.
What is the molecular weight of 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea?
The molecular weight of 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea is 356.99 g/mol.
Where can I buy 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea?
You can request a quote for 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-Dichlorophenyl)-3-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.