1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea
TL;DR: 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea (CAS 852139-41-4) is a chemical compound with molecular formula C15H21N3S and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-3-[(2-methyl-1H-indol-5-yl)methyl]thiourea
Also Known As: 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea, 3-BUTYL-1-[(2-METHYL-1H-INDOL-5-YL)METHYL]THIOUREA, 1-butyl-3-[(2-methyl-1H-indol-5-yl)methyl]thiourea, 1-butyl-3-[(2-methyl-5-indolyl)methyl]thiourea
| Molecular Formula | C15H21N3S |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 3.24052 |
| Topological Polar Surface Area | 39.85 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.14563 |
| Heavy Atoms | 19 |
| Complexity | 559.51605 |
Chemical Identifiers
| CAS Number | 852139-41-4 |
|---|---|
| SMILES | CCCCNC(=S)NCC1=CC2=C(C=C1)NC(=C2)C |
Product Overview
1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea (CAS 852139-41-4), with molecular formula C15H21N3S and molecular weight 275.15 g/mol. IUPAC: 1-butyl-3-[(2-methyl-1H-indol-5-yl)methyl]thiourea.
Chemical Property Profile of 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea
Property Insights of 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea
The XLogP value of 3.24052 indicates that 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.85 Ų, 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea has 3 hydrogen bond donor(s) and 1 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-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea?
The CAS number of 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea is 852139-41-4.
What is the molecular formula of 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea?
The molecular formula of 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea is C15H21N3S.
What is the molecular weight of 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea?
The molecular weight of 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea is 275.15 g/mol.
Where can I buy 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea?
You can request a quote for 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-butyl-3-((2-methyl-1H-indol-5-yl)methyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.