![({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide structure](/static/products/1002/1002539-77-6.webp)
({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide
TL;DR: ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide (CAS 1002539-77-6) is a chemical compound with molecular formula C16H14ClN3S and molecular weight 315.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[(2-chlorophenyl)methyl]indol-3-yl] carbamimidothioate
Also Known As: starbld0023911, 1-(2-Chlorobenzyl)-1H-indol-3-yl carbamimidothioate, ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide, [1-[(2-chlorophenyl)methyl]indol-3-yl] carbamimidothioate, ({1-[(2-chlorophenyl)methyl]indol-3-yl}sulfanyl)methanimidamide
| Molecular Formula | C16H14ClN3S |
|---|---|
| Molecular Weight | 315.06 g/mol |
| LogP | 4.32857 |
| Topological Polar Surface Area | 54.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.0597 |
| Heavy Atoms | 21 |
| Complexity | 810.1422 |
Chemical Identifiers
| CAS Number | 1002539-77-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN2C=C(C3=CC=CC=C32)SC(=N)N)Cl |
Product Overview
({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide (CAS 1002539-77-6), with molecular formula C16H14ClN3S and molecular weight 315.06 g/mol. IUPAC: [1-[(2-chlorophenyl)methyl]indol-3-yl] carbamimidothioate.
Chemical Property Profile of ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide
Property Insights of ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide
The XLogP value of 4.32857 indicates that ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.8 Ų, ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide has 2 hydrogen bond donor(s) and 2 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-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide?
The CAS number of ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide is 1002539-77-6.
What is the molecular formula of ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide?
The molecular formula of ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide is C16H14ClN3S.
What is the molecular weight of ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide?
The molecular weight of ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide is 315.06 g/mol.
Where can I buy ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide?
You can request a quote for ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide?
Yes, KEHONG BIO provides custom synthesis services for ({1-[(2-chlorophenyl)methyl]-1H-indol-3-yl}sulfanyl)methanimidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.