BAS 00675182
TL;DR: BAS 00675182 (CAS 314282-25-2) is a chemical compound with molecular formula C14H11N3S and molecular weight 253.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-pyridin-3-ylmethylideneamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
Also Known As: BAS 00675182, 2-[(3-pyridinylmethylene)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile, 2-[(E)-pyridin-3-ylmethylideneamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile, (E)-2-((pyridin-3-ylmethylene)amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile, 2-{[(E)-pyridin-3-ylmethylidene]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
| Molecular Formula | C14H11N3S |
|---|---|
| Molecular Weight | 253.07 g/mol |
| LogP | 3.25408 |
| Topological Polar Surface Area | 49.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 253.06737 |
| Heavy Atoms | 18 |
| Complexity | 635.049 |
Chemical Identifiers
| CAS Number | 314282-25-2 |
|---|---|
| SMILES | C1CC2=C(C1)SC(=C2C#N)/N=C/C3=CN=CC=C3 |
Product Overview
BAS 00675182 (CAS 314282-25-2), with molecular formula C14H11N3S and molecular weight 253.07 g/mol. IUPAC: 2-[(E)-pyridin-3-ylmethylideneamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile.
Chemical Property Profile of BAS 00675182
Property Insights of BAS 00675182
The XLogP value of 3.25408 indicates that BAS 00675182 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.04 Ų, BAS 00675182 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00675182 has 0 hydrogen bond donor(s) and 4 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 BAS 00675182?
The CAS number of BAS 00675182 is 314282-25-2.
What is the molecular formula of BAS 00675182?
The molecular formula of BAS 00675182 is C14H11N3S.
What is the molecular weight of BAS 00675182?
The molecular weight of BAS 00675182 is 253.07 g/mol.
Where can I buy BAS 00675182?
You can request a quote for BAS 00675182 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00675182?
Yes, KEHONG BIO provides custom synthesis services for BAS 00675182 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.