F0574-0104
TL;DR: F0574-0104 (CAS 501352-70-1) is a chemical compound with molecular formula C27H29ClN2O4S and molecular weight 512.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-2-methylphenyl)-6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide
Also Known As: F0574-0104, N-(3-chloro-2-methylphenyl)-6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-2-carbothioamide, N-(3-chloro-2-methylphenyl)-6,7-dimethoxy-1-((4-methoxyphenoxy)methyl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide, N-(3-chloro-2-methylphenyl)-6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide
| Molecular Formula | C27H29ClN2O4S |
|---|---|
| Molecular Weight | 512.15 g/mol |
| LogP | 6.04942 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 512.1537 |
| Heavy Atoms | 35 |
| Complexity | 1202.5308 |
Chemical Identifiers
| CAS Number | 501352-70-1 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=S)N2CCC3=CC(=C(C=C3C2COC4=CC=C(C=C4)OC)OC)OC |
Product Overview
F0574-0104 (CAS 501352-70-1), with molecular formula C27H29ClN2O4S and molecular weight 512.15 g/mol. IUPAC: N-(3-chloro-2-methylphenyl)-6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide.
Chemical Property Profile of F0574-0104
Property Insights of F0574-0104
The XLogP value of 6.04942 indicates that F0574-0104 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.19 Ų, F0574-0104 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0574-0104 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0574-0104?
The CAS number of F0574-0104 is 501352-70-1.
What is the molecular formula of F0574-0104?
The molecular formula of F0574-0104 is C27H29ClN2O4S.
What is the molecular weight of F0574-0104?
The molecular weight of F0574-0104 is 512.15 g/mol.
Where can I buy F0574-0104?
You can request a quote for F0574-0104 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0574-0104?
Yes, KEHONG BIO provides custom synthesis services for F0574-0104 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.