4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide
TL;DR: 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide (CAS 690991-85-6) is a chemical compound with molecular formula C18H18N4OS and molecular weight 338.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzothiazol-2-yl)-N-phenylpiperazine-1-carboxamide
Also Known As: 4-(1,3-benzothiazol-2-yl)-N-phenylpiperazine-1-carboxamide, 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide, 4-(benzo[d]thiazol-2-yl)-N-phenylpiperazine-1-carboxamide, F5772-8663
| Molecular Formula | C18H18N4OS |
|---|---|
| Molecular Weight | 338.12 g/mol |
| LogP | 3.6504 |
| Topological Polar Surface Area | 48.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.12012 |
| Heavy Atoms | 24 |
| Complexity | 807.3608 |
Chemical Identifiers
| CAS Number | 690991-85-6 |
|---|---|
| SMILES | C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)NC4=CC=CC=C4 |
Product Overview
4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide (CAS 690991-85-6), with molecular formula C18H18N4OS and molecular weight 338.12 g/mol. IUPAC: 4-(1,3-benzothiazol-2-yl)-N-phenylpiperazine-1-carboxamide.
Chemical Property Profile of 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide
Property Insights of 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide
The XLogP value of 3.6504 indicates that 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.47 Ų, 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide 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 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide?
The CAS number of 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide is 690991-85-6.
What is the molecular formula of 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide?
The molecular formula of 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide is C18H18N4OS.
What is the molecular weight of 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide?
The molecular weight of 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide is 338.12 g/mol.
Where can I buy 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide?
You can request a quote for 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,3-benzothiazol-2-yl)-N-phenyl-1-piperazinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.