![[[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea structure](/static/products/6877/68770-69-4.webp)
[[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea
TL;DR: [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea (CAS 68770-69-4) is a chemical compound with molecular formula C18H15BrN4OS and molecular weight 414.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[2-bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea
Also Known As: [(E)-[2-bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino|[[2-bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea
| Molecular Formula | C18H15BrN4OS |
|---|---|
| Molecular Weight | 414.01 g/mol |
| LogP | 3.56782 |
| Topological Polar Surface Area | 72.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.01498 |
| Heavy Atoms | 25 |
| Complexity | 992.22876 |
Chemical Identifiers
| CAS Number | 68770-69-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3C(=C2Br)C=NNC(=S)N |
Product Overview
[[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea (CAS 68770-69-4), with molecular formula C18H15BrN4OS and molecular weight 414.01 g/mol. IUPAC: [[2-bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea.
Chemical Property Profile of [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea
Property Insights of [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea
The XLogP value of 3.56782 indicates that [[2-Bromo-1-(4-methylbenzoyl)indol-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 [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea. Following Lipinski's Rule of Five, [[2-Bromo-1-(4-methylbenzoyl)indol-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 [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea?
The CAS number of [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea is 68770-69-4.
What is the molecular formula of [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea?
The molecular formula of [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea is C18H15BrN4OS.
What is the molecular weight of [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea?
The molecular weight of [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea is 414.01 g/mol.
Where can I buy [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea?
You can request a quote for [[2-Bromo-1-(4-methylbenzoyl)indol-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 [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [[2-Bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.