1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate
TL;DR: 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate (CAS 27077-16-3) is a chemical compound with molecular formula C24H30N2O6 and molecular weight 442.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(dimethylamino)propyl]-3,3-dimethyl-N-phenyl-2-benzofuran-1-carboxamide;oxalic acid
Also Known As: LU 4-073 oxalate, KST-1B2490, 3,3-Dimethyl-1-(3-(dimethylamino)propyl)-1-phthalancarboxanilide oxalate, 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate, 1-[3-(dimethylamino)propyl]-3,3-dimethyl-n-phenyl-1,3-dihydro-2-benzofuran-1-carboxamide ethanedioate(1:1)
| Molecular Formula | C24H30N2O6 |
|---|---|
| Molecular Weight | 442.21 g/mol |
| LogP | 3.2833 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.2104 |
| Heavy Atoms | 32 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 27077-16-3 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2C(O1)(CCCN(C)C)C(=O)NC3=CC=CC=C3)C.C(=O)(C(=O)O)O |
| InChIKey | PJDOYXYBDPGITP-UHFFFAOYSA-N |
Product Overview
1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate (CAS 27077-16-3), with molecular formula C24H30N2O6 and molecular weight 442.21 g/mol. IUPAC: 1-[3-(dimethylamino)propyl]-3,3-dimethyl-N-phenyl-2-benzofuran-1-carboxamide;oxalic acid.
Chemical Property Profile of 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate
Property Insights of 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate
The XLogP value of 3.2833 indicates that 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate. Following Lipinski's Rule of Five, 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate?
The CAS number of 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate is 27077-16-3.
What is the molecular formula of 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate?
The molecular formula of 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate is C24H30N2O6.
What is the molecular weight of 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate?
The molecular weight of 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate is 442.21 g/mol.
Where can I buy 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate?
You can request a quote for 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate?
Yes, KEHONG BIO provides custom synthesis services for 1-Phthalancarboxanilide, 3,3-dimethyl-1-(3-(dimethylamino)propyl)-, oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.