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[(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea
TL;DR: [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea (CAS 57989-50-1) is a chemical compound with molecular formula C17H13ClN4OS and molecular weight 356.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1-benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea
Also Known As: [(1-benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea|[(E)-(1-benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea
| Molecular Formula | C17H13ClN4OS |
|---|---|
| Molecular Weight | 356.05 g/mol |
| LogP | 3.1503 |
| Topological Polar Surface Area | 72.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.04987 |
| Heavy Atoms | 24 |
| Complexity | 949.88385 |
Chemical Identifiers
| CAS Number | 57989-50-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3C(=C2Cl)C=NNC(=S)N |
Product Overview
[(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea (CAS 57989-50-1), with molecular formula C17H13ClN4OS and molecular weight 356.05 g/mol. IUPAC: [(1-benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea.
Chemical Property Profile of [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea
Property Insights of [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea
The XLogP value of 3.1503 indicates that [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.41 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea. Following Lipinski's Rule of Five, [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea has 2 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 [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea?
The CAS number of [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea is 57989-50-1.
What is the molecular formula of [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea?
The molecular formula of [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea is C17H13ClN4OS.
What is the molecular weight of [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea?
The molecular weight of [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea is 356.05 g/mol.
Where can I buy [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea?
You can request a quote for [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [(1-Benzoyl-2-chloroindol-3-yl)methylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.