ASN 03778853
TL;DR: ASN 03778853 (CAS 460712-61-2) is a chemical compound with molecular formula C26H25N3O6S and molecular weight 507.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-ylmethyl)-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(furan-2-ylmethyl)thiourea
Also Known As: ASN 03778853, 1-(1,3-benzodioxol-5-ylmethyl)-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(furan-2-ylmethyl)thiourea
| Molecular Formula | C26H25N3O6S |
|---|---|
| Molecular Weight | 507.15 g/mol |
| LogP | 3.9439 |
| Topological Polar Surface Area | 98.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 507.1464 |
| Heavy Atoms | 36 |
| Complexity | 1450.3395 |
Chemical Identifiers
| CAS Number | 460712-61-2 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)C(=S)NCC5=CC=CO5)OC |
Product Overview
ASN 03778853 (CAS 460712-61-2), with molecular formula C26H25N3O6S and molecular weight 507.15 g/mol. IUPAC: 1-(1,3-benzodioxol-5-ylmethyl)-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(furan-2-ylmethyl)thiourea.
Chemical Property Profile of ASN 03778853
Property Insights of ASN 03778853
The XLogP value of 3.9439 indicates that ASN 03778853 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.19 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 03778853. Following Lipinski's Rule of Five, ASN 03778853 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ASN 03778853?
The CAS number of ASN 03778853 is 460712-61-2.
What is the molecular formula of ASN 03778853?
The molecular formula of ASN 03778853 is C26H25N3O6S.
What is the molecular weight of ASN 03778853?
The molecular weight of ASN 03778853 is 507.15 g/mol.
Where can I buy ASN 03778853?
You can request a quote for ASN 03778853 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 03778853?
Yes, KEHONG BIO provides custom synthesis services for ASN 03778853 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.