{2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide
TL;DR: {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide (CAS 796083-74-4) is a chemical compound with molecular formula C17H15Cl2N3O2S and molecular weight 395.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,4-dichlorophenyl)methyl]-N,N,5-trimethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide
Also Known As: {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide, 2-[(2,4-dichlorophenyl)methyl]-N,N,5-trimethyl-4-oxo-3H,4H-thieno[2,3-d]pyrimidine-6-carboxamide, 2-[(2,4-dichlorophenyl)methyl]-N,N,5-trimethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide
| Molecular Formula | C17H15Cl2N3O2S |
|---|---|
| Molecular Weight | 395.03 g/mol |
| LogP | 3.89242 |
| Topological Polar Surface Area | 66.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.0262 |
| Heavy Atoms | 25 |
| Complexity | 1040.2844 |
Chemical Identifiers
| CAS Number | 796083-74-4 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)NC(=N2)CC3=C(C=C(C=C3)Cl)Cl)C(=O)N(C)C |
Product Overview
{2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide (CAS 796083-74-4), with molecular formula C17H15Cl2N3O2S and molecular weight 395.03 g/mol. IUPAC: 2-[(2,4-dichlorophenyl)methyl]-N,N,5-trimethyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide.
Chemical Property Profile of {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide
Property Insights of {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide
The XLogP value of 3.89242 indicates that {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.06 Ų falls within the moderate polarity range, balancing permeability and solubility for {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide. Following Lipinski's Rule of Five, {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide has 1 hydrogen bond donor(s) and 4 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 {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide?
The CAS number of {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide is 796083-74-4.
What is the molecular formula of {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide?
The molecular formula of {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide is C17H15Cl2N3O2S.
What is the molecular weight of {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide?
The molecular weight of {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide is 395.03 g/mol.
Where can I buy {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide?
You can request a quote for {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide?
Yes, KEHONG BIO provides custom synthesis services for {2-[(2,4-dichlorophenyl)methyl]-5-methyl-4-oxo(3-hydrothiopheno[2,3-d]pyrimidi n-6-yl)}-N,N-dimethylcarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.