Pentanethioamide, N-(phenylmethyl)-
TL;DR: Pentanethioamide, N-(phenylmethyl)- (CAS 163313-56-2) is a chemical compound with molecular formula C12H17NS and molecular weight 207.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzylpentanethioamide
Also Known As: N-benzylpentanethioamide, Pentanethioamide, N-(phenylmethyl)-, Pentanethioamide,N-(phenylmethyl), RefChem:368154
| Molecular Formula | C12H17NS |
|---|---|
| Molecular Weight | 207.11 g/mol |
| LogP | 3.2938 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 207.10817 |
| Heavy Atoms | 14 |
| Complexity | 268.91003 |
Chemical Identifiers
| CAS Number | 163313-56-2 |
|---|---|
| SMILES | CCCCC(=S)NCC1=CC=CC=C1 |
Product Overview
Pentanethioamide, N-(phenylmethyl)- (CAS 163313-56-2), with molecular formula C12H17NS and molecular weight 207.11 g/mol. IUPAC: N-benzylpentanethioamide.
Chemical Property Profile of Pentanethioamide, N-(phenylmethyl)-
Property Insights of Pentanethioamide, N-(phenylmethyl)-
The XLogP value of 3.2938 indicates that Pentanethioamide, N-(phenylmethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, Pentanethioamide, N-(phenylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentanethioamide, N-(phenylmethyl)- has 1 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 Pentanethioamide, N-(phenylmethyl)-?
The CAS number of Pentanethioamide, N-(phenylmethyl)- is 163313-56-2.
What is the molecular formula of Pentanethioamide, N-(phenylmethyl)-?
The molecular formula of Pentanethioamide, N-(phenylmethyl)- is C12H17NS.
What is the molecular weight of Pentanethioamide, N-(phenylmethyl)-?
The molecular weight of Pentanethioamide, N-(phenylmethyl)- is 207.11 g/mol.
Where can I buy Pentanethioamide, N-(phenylmethyl)-?
You can request a quote for Pentanethioamide, N-(phenylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentanethioamide, N-(phenylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pentanethioamide, N-(phenylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.