RefChem:512939
TL;DR: RefChem:512939 (CAS 476483-24-6) is a chemical compound with molecular formula C30H32N4O5S and molecular weight 560.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(2-amino-2-oxoethyl)-4-methoxyphenyl]-N-(5-methoxy-1,3-benzothiazol-2-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide
Also Known As: 4-(3-(2-Amino-2-oxoethyl)-4-methoxyphenyl)-N-(5-methoxybenzo[d]thiazol-2-yl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide, 4-(3-(2-Amino-2-oxoethyl)-4-methoxyphenyl)-N-(5-methoxy-1,3-benzothiazol-2-YL)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamid E, 4-[3-(2-AMINO-2-OXOETHYL)-4-METHOXYPHENYL]-N-(5-METHOXY-1,3-BENZOTHIAZOL-2-YL)-2,7,7-TRIMETHYL-5-OXO-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBOXAMID E, 4-[3-(2-AMINO-2-OXOETHYL)-4-METHOXYPHENYL]-N-(5-METHOXY-1,3-BENZOTHIAZOL-2-YL)-2,7,7-TRIMETHYL-5-OXO-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBOXAMIDE, 4-[3-(2-amino-2-oxoethyl)-4-methoxyphenyl]-N-(5-methoxy-1,3-benzothiazol-2-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide
| Molecular Formula | C30H32N4O5S |
|---|---|
| Molecular Weight | 560.21 g/mol |
| LogP | 4.584 |
| Topological Polar Surface Area | 132.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 560.20935 |
| Heavy Atoms | 40 |
| Complexity | 1617.242 |
Chemical Identifiers
| CAS Number | 476483-24-6 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=C(C=C3)OC)CC(=O)N)C(=O)NC4=NC5=C(S4)C=CC(=C5)OC |
Product Overview
RefChem:512939 (CAS 476483-24-6), with molecular formula C30H32N4O5S and molecular weight 560.21 g/mol. IUPAC: 4-[3-(2-amino-2-oxoethyl)-4-methoxyphenyl]-N-(5-methoxy-1,3-benzothiazol-2-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxamide.
Chemical Property Profile of RefChem:512939
Property Insights of RefChem:512939
The XLogP value of 4.584 indicates that RefChem:512939 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.64 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:512939. Following Lipinski's Rule of Five, RefChem:512939 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:512939?
The CAS number of RefChem:512939 is 476483-24-6.
What is the molecular formula of RefChem:512939?
The molecular formula of RefChem:512939 is C30H32N4O5S.
What is the molecular weight of RefChem:512939?
The molecular weight of RefChem:512939 is 560.21 g/mol.
Where can I buy RefChem:512939?
You can request a quote for RefChem:512939 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:512939?
Yes, KEHONG BIO provides custom synthesis services for RefChem:512939 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.