PD 198306
TL;DR: PD 198306 (CAS 212631-61-3) is a chemical compound with molecular formula C18H16F3IN2O2 and molecular weight 476.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyclopropylmethoxy)-3,4,5-trifluoro-2-(4-iodo-2-methylanilino)benzamide
Also Known As: SID:134222749, Benzamide, N-(cyclopropylmethoxy)-3,4,5-trifluoro-2-((4-iodo-2-methylphenyl)amino)-, N-(Cyclopropylmethoxy)-3,4,5-trifluoro-2-((4-iodo-2-methylphenyl)amino)benzamide, N-(cyclopropylmethoxy)-3,4,5-trifluoro-2-(4-iodo-2-methylanilino)benzamide, BRD-K88677950-001-01-3
| Molecular Formula | C18H16F3IN2O2 |
|---|---|
| Molecular Weight | 476.02 g/mol |
| LogP | 4.83192 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 476.02087 |
| Heavy Atoms | 26 |
| Complexity | 856.81525 |
Chemical Identifiers
| CAS Number | 212631-61-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)I)NC2=C(C(=C(C=C2C(=O)NOCC3CC3)F)F)F |
Product Overview
PD 198306 (CAS 212631-61-3), with molecular formula C18H16F3IN2O2 and molecular weight 476.02 g/mol. IUPAC: N-(cyclopropylmethoxy)-3,4,5-trifluoro-2-(4-iodo-2-methylanilino)benzamide.
Chemical Property Profile of PD 198306
Property Insights of PD 198306
The XLogP value of 4.83192 indicates that PD 198306 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, PD 198306 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, PD 198306 has 2 hydrogen bond donor(s) and 3 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 PD 198306?
The CAS number of PD 198306 is 212631-61-3.
What is the molecular formula of PD 198306?
The molecular formula of PD 198306 is C18H16F3IN2O2.
What is the molecular weight of PD 198306?
The molecular weight of PD 198306 is 476.02 g/mol.
Where can I buy PD 198306?
You can request a quote for PD 198306 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PD 198306?
Yes, KEHONG BIO provides custom synthesis services for PD 198306 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.