![(3-Methylseleno-2-benzo[b]thienylidene)aniline structure](/static/products/7174/71740-03-9.webp)
(3-Methylseleno-2-benzo[b]thienylidene)aniline
TL;DR: (3-Methylseleno-2-benzo[b]thienylidene)aniline (CAS 71740-03-9) is a chemical compound with molecular formula C16H13NSSe and molecular weight 330.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-methylselanyl-1-benzothiophen-2-yl)-N-phenylmethanimine
Also Known As: (3-Methylseleno-2-benzo[b]thienylidene)aniline, 1-(3-methylselanyl-1-benzothiophen-2-yl)-N-phenylmethanimine, Benzenamine, N-[[3-(methylseleno)benzo[b]thien-2-yl]methylene]-, (E)-1-[3-(Methylselanyl)-1-benzothiophen-2-yl]-N-phenylmethanimine, N-((E)-[3-(Methylselanyl)-1-benzothien-2-yl]methylidene)aniline #
| Molecular Formula | C16H13NSSe |
|---|---|
| Molecular Weight | 330.99 g/mol |
| LogP | 4.0295 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.99338 |
| Heavy Atoms | 19 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 71740-03-9 |
|---|---|
| SMILES | C[Se]C1=C(SC2=CC=CC=C21)C=NC3=CC=CC=C3 |
| InChIKey | UGGSBFCYYSJCCS-UHFFFAOYSA-N |
Product Overview
(3-Methylseleno-2-benzo[b]thienylidene)aniline (CAS 71740-03-9), with molecular formula C16H13NSSe and molecular weight 330.99 g/mol. IUPAC: 1-(3-methylselanyl-1-benzothiophen-2-yl)-N-phenylmethanimine.
Chemical Property Profile of (3-Methylseleno-2-benzo[b]thienylidene)aniline
Property Insights of (3-Methylseleno-2-benzo[b]thienylidene)aniline
The XLogP value of 4.0295 indicates that (3-Methylseleno-2-benzo[b]thienylidene)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.6 Ų, (3-Methylseleno-2-benzo[b]thienylidene)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Methylseleno-2-benzo[b]thienylidene)aniline has 0 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 (3-Methylseleno-2-benzo[b]thienylidene)aniline?
The CAS number of (3-Methylseleno-2-benzo[b]thienylidene)aniline is 71740-03-9.
What is the molecular formula of (3-Methylseleno-2-benzo[b]thienylidene)aniline?
The molecular formula of (3-Methylseleno-2-benzo[b]thienylidene)aniline is C16H13NSSe.
What is the molecular weight of (3-Methylseleno-2-benzo[b]thienylidene)aniline?
The molecular weight of (3-Methylseleno-2-benzo[b]thienylidene)aniline is 330.99 g/mol.
Where can I buy (3-Methylseleno-2-benzo[b]thienylidene)aniline?
You can request a quote for (3-Methylseleno-2-benzo[b]thienylidene)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Methylseleno-2-benzo[b]thienylidene)aniline?
Yes, KEHONG BIO provides custom synthesis services for (3-Methylseleno-2-benzo[b]thienylidene)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.