AB00109194-01
TL;DR: AB00109194-01 (CAS 428505-45-7) is a chemical compound with molecular formula C28H21N3O4S and molecular weight 495.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-methoxy-4-(naphthalene-1-carbonylcarbamothioylamino)phenyl]-1-benzofuran-2-carboxamide
Also Known As: AB00109194-01, N-[2-methoxy-4-(naphthalene-1-carbonylcarbamothioylamino)phenyl]-1-benzofuran-2-carboxamide, N-(2-methoxy-4-{[(naphthalen-1-ylcarbonyl)carbamothioyl]amino}phenyl)-1-benzofuran-2-carboxamide, N-[2-methoxy-4-(naphthalene-1-carbonylthiocarbamoylamino)phenyl]benzofuran-2-carboxamide
| Molecular Formula | C28H21N3O4S |
|---|---|
| Molecular Weight | 495.13 g/mol |
| LogP | 5.9737 |
| Topological Polar Surface Area | 92.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 495.12527 |
| Heavy Atoms | 36 |
| Complexity | 1587.8301 |
Chemical Identifiers
| CAS Number | 428505-45-7 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CC3=CC=CC=C32)NC(=O)C4=CC5=CC=CC=C5O4 |
Product Overview
AB00109194-01 (CAS 428505-45-7), with molecular formula C28H21N3O4S and molecular weight 495.13 g/mol. IUPAC: N-[2-methoxy-4-(naphthalene-1-carbonylcarbamothioylamino)phenyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of AB00109194-01
Property Insights of AB00109194-01
The XLogP value of 5.9737 indicates that AB00109194-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.6 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00109194-01. Following Lipinski's Rule of Five, AB00109194-01 has 3 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 AB00109194-01?
The CAS number of AB00109194-01 is 428505-45-7.
What is the molecular formula of AB00109194-01?
The molecular formula of AB00109194-01 is C28H21N3O4S.
What is the molecular weight of AB00109194-01?
The molecular weight of AB00109194-01 is 495.13 g/mol.
Where can I buy AB00109194-01?
You can request a quote for AB00109194-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00109194-01?
Yes, KEHONG BIO provides custom synthesis services for AB00109194-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.