N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide
TL;DR: N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide (CAS 642948-82-1) is a chemical compound with molecular formula C16H13N3O3S and molecular weight 327.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydroindole-1-carbothioyl)-4-nitrobenzamide
Also Known As: N-(INDOLINYLTHIOXOMETHYL)(4-NITROPHENYL)FORMAMIDE, N-(2,3-dihydro-1H-indole-1-carbothioyl)-4-nitrobenzamide, N-(indoline-1-carbothioyl)-4-nitro-benzamide, N-(2,3-dihydroindole-1-carbothioyl)-4-nitrobenzamide, N-(2,3-dihydroindole-1-carbothioyl)-4-nitro-benzamide
| Molecular Formula | C16H13N3O3S |
|---|---|
| Molecular Weight | 327.07 g/mol |
| LogP | 2.6722 |
| Topological Polar Surface Area | 75.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.06775 |
| Heavy Atoms | 23 |
| Complexity | 789.4124 |
Chemical Identifiers
| CAS Number | 642948-82-1 |
|---|---|
| SMILES | C1CN(C2=CC=CC=C21)C(=S)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide (CAS 642948-82-1), with molecular formula C16H13N3O3S and molecular weight 327.07 g/mol. IUPAC: N-(2,3-dihydroindole-1-carbothioyl)-4-nitrobenzamide.
Chemical Property Profile of N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide
Property Insights of N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide
The XLogP value of 2.6722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide. The TPSA of 75.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide. Following Lipinski's Rule of Five, N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide 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 N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide?
The CAS number of N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide is 642948-82-1.
What is the molecular formula of N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide?
The molecular formula of N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide is C16H13N3O3S.
What is the molecular weight of N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide?
The molecular weight of N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide is 327.07 g/mol.
Where can I buy N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide?
You can request a quote for N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide?
Yes, KEHONG BIO provides custom synthesis services for N-(Indolinylthioxomethyl)(4-nitrophenyl)formamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.