ChemDiv3_005489
TL;DR: ChemDiv3_005489 (CAS 384375-32-0) is a chemical compound with molecular formula C19H23N3OS and molecular weight 341.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(dimethylamino)phenyl]-3-methyl-1,2,5,6,7,8-hexahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: ChemDiv3_005489, IDI1_023399, 2-(4-(dimethylamino)phenyl)-3-methyl-2,3,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(1H)-one, 2-(4-dimethylaminophenyl)-3-methyl-1,2,5,6,7,8-hexahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 2-[4-(dimethylamino)phenyl]-3-methyl-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
| Molecular Formula | C19H23N3OS |
|---|---|
| Molecular Weight | 341.16 g/mol |
| LogP | 3.8892 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.1562 |
| Heavy Atoms | 24 |
| Complexity | 778.6547 |
Chemical Identifiers
| CAS Number | 384375-32-0 |
|---|---|
| SMILES | CN1C(NC2=C(C1=O)C3=C(S2)CCCC3)C4=CC=C(C=C4)N(C)C |
Product Overview
ChemDiv3_005489 (CAS 384375-32-0), with molecular formula C19H23N3OS and molecular weight 341.16 g/mol. IUPAC: 2-[4-(dimethylamino)phenyl]-3-methyl-1,2,5,6,7,8-hexahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of ChemDiv3_005489
Property Insights of ChemDiv3_005489
The XLogP value of 3.8892 indicates that ChemDiv3_005489 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.58 Ų, ChemDiv3_005489 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_005489 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 ChemDiv3_005489?
The CAS number of ChemDiv3_005489 is 384375-32-0.
What is the molecular formula of ChemDiv3_005489?
The molecular formula of ChemDiv3_005489 is C19H23N3OS.
What is the molecular weight of ChemDiv3_005489?
The molecular weight of ChemDiv3_005489 is 341.16 g/mol.
Where can I buy ChemDiv3_005489?
You can request a quote for ChemDiv3_005489 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_005489?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_005489 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.