N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide
TL;DR: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide (CAS 903199-06-4) is a chemical compound with molecular formula C16H24N4O3S and molecular weight 352.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-[3-(dimethylamino)propyl]oxamide
Also Known As: N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide, N'-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-[3-(dimethylamino)propyl]oxamide, N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N'-[3-(dimethylamino)propyl]ethanediamide, N1-(3-carbamoyl-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-N2-(3-(dimethylamino)propyl)oxalamide
| Molecular Formula | C16H24N4O3S |
|---|---|
| Molecular Weight | 352.16 g/mol |
| LogP | 0.7322 |
| Topological Polar Surface Area | 104.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 352.15692 |
| Heavy Atoms | 24 |
| Complexity | 639.5122 |
Chemical Identifiers
| CAS Number | 903199-06-4 |
|---|---|
| SMILES | CN(C)CCCNC(=O)C(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N |
Product Overview
N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide (CAS 903199-06-4), with molecular formula C16H24N4O3S and molecular weight 352.16 g/mol. IUPAC: N'-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-N-[3-(dimethylamino)propyl]oxamide.
Chemical Property Profile of N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide
Property Insights of N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide
The XLogP value of 0.7322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide. The TPSA of 104.53 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide. Following Lipinski's Rule of Five, N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide has 3 hydrogen bond donor(s) and 5 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 N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide?
The CAS number of N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide is 903199-06-4.
What is the molecular formula of N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide?
The molecular formula of N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide is C16H24N4O3S.
What is the molecular weight of N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide?
The molecular weight of N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide is 352.16 g/mol.
Where can I buy N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide?
You can request a quote for N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-N'-(3-dimethylaminopropyl)oxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.