ChemDiv1_005049
TL;DR: ChemDiv1_005049 (CAS 361173-29-7) is a chemical compound with molecular formula C29H23N3O4S and molecular weight 509.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide
Also Known As: ChemDiv1_005049, N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(1,2,3,4-tetrahydroquinoline-1-sulfonyl)benzamide, F0817-0226, N-(4-(benzo[d]oxazol-2-yl)phenyl)-4-((3,4-dihydroquinolin-1(2H)-yl)sulfonyl)benzamide, N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide
| Molecular Formula | C29H23N3O4S |
|---|---|
| Molecular Weight | 509.14 g/mol |
| LogP | 5.8886 |
| Topological Polar Surface Area | 92.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 509.14093 |
| Heavy Atoms | 37 |
| Complexity | 1675.7091 |
Chemical Identifiers
| CAS Number | 361173-29-7 |
|---|---|
| SMILES | C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6O5 |
Product Overview
ChemDiv1_005049 (CAS 361173-29-7), with molecular formula C29H23N3O4S and molecular weight 509.14 g/mol. IUPAC: N-[4-(1,3-benzoxazol-2-yl)phenyl]-4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)benzamide.
Chemical Property Profile of ChemDiv1_005049
Property Insights of ChemDiv1_005049
The XLogP value of 5.8886 indicates that ChemDiv1_005049 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.51 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005049. Following Lipinski's Rule of Five, ChemDiv1_005049 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 ChemDiv1_005049?
The CAS number of ChemDiv1_005049 is 361173-29-7.
What is the molecular formula of ChemDiv1_005049?
The molecular formula of ChemDiv1_005049 is C29H23N3O4S.
What is the molecular weight of ChemDiv1_005049?
The molecular weight of ChemDiv1_005049 is 509.14 g/mol.
Where can I buy ChemDiv1_005049?
You can request a quote for ChemDiv1_005049 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005049?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005049 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.