BAS 07418395
TL;DR: BAS 07418395 (CAS 674805-54-0) is a chemical compound with molecular formula C14H9ClF3N3S and molecular weight 343.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-chloro-3-pyridinyl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile
Also Known As: BAS 07418395, 2-{[(6-chloro-3-pyridinyl)methyl]sulfanyl}-6-methyl-4-(trifluoromethyl)nicotinonitrile, 2-{[(6-chloropyridin-3-yl)methyl]sulfanyl}-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile, AM-807/41931568, 2-[(6-chloropyridin-3-yl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile
| Molecular Formula | C14H9ClF3N3S |
|---|---|
| Molecular Weight | 343.02 g/mol |
| LogP | 4.6212 |
| Topological Polar Surface Area | 49.57 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.01578 |
| Heavy Atoms | 22 |
| Complexity | 723.8385 |
Chemical Identifiers
| CAS Number | 674805-54-0 |
|---|---|
| SMILES | CC1=CC(=C(C(=N1)SCC2=CN=C(C=C2)Cl)C#N)C(F)(F)F |
Product Overview
BAS 07418395 (CAS 674805-54-0), with molecular formula C14H9ClF3N3S and molecular weight 343.02 g/mol. IUPAC: 2-[(6-chloro-3-pyridinyl)methylsulfanyl]-6-methyl-4-(trifluoromethyl)pyridine-3-carbonitrile.
Chemical Property Profile of BAS 07418395
Property Insights of BAS 07418395
The XLogP value of 4.6212 indicates that BAS 07418395 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.57 Ų, BAS 07418395 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 07418395 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 07418395?
The CAS number of BAS 07418395 is 674805-54-0.
What is the molecular formula of BAS 07418395?
The molecular formula of BAS 07418395 is C14H9ClF3N3S.
What is the molecular weight of BAS 07418395?
The molecular weight of BAS 07418395 is 343.02 g/mol.
Where can I buy BAS 07418395?
You can request a quote for BAS 07418395 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07418395?
Yes, KEHONG BIO provides custom synthesis services for BAS 07418395 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.