UPCMLD0ENAT0507-5179:001
TL;DR: UPCMLD0ENAT0507-5179:001 (CAS 379253-32-4) is a chemical compound with molecular formula C16H13ClN2OS3 and molecular weight 379.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chlorothiophen-2-yl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)ethanone
Also Known As: UPCMLD0ENAT0507-5179:001, 1-(5-chlorothiophen-2-yl)-2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)ethanone, F1043-0635, 1-(5-chlorothiophen-2-yl)-2-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylsulfanyl)ethanone, 1-(5-chlorothiophen-2-yl)-2-{8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5-tetraen-3-ylsulfanyl}ethan-1-one
| Molecular Formula | C16H13ClN2OS3 |
|---|---|
| Molecular Weight | 379.99 g/mol |
| LogP | 5.26 |
| Topological Polar Surface Area | 42.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 379.98785 |
| Heavy Atoms | 23 |
| Complexity | 886.7131 |
Chemical Identifiers
| CAS Number | 379253-32-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=CN=C3SCC(=O)C4=CC=C(S4)Cl |
Product Overview
UPCMLD0ENAT0507-5179:001 (CAS 379253-32-4), with molecular formula C16H13ClN2OS3 and molecular weight 379.99 g/mol. IUPAC: 1-(5-chlorothiophen-2-yl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)ethanone.
Chemical Property Profile of UPCMLD0ENAT0507-5179:001
Property Insights of UPCMLD0ENAT0507-5179:001
The XLogP value of 5.26 indicates that UPCMLD0ENAT0507-5179:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.85 Ų, UPCMLD0ENAT0507-5179:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0507-5179:001 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT0507-5179:001?
The CAS number of UPCMLD0ENAT0507-5179:001 is 379253-32-4.
What is the molecular formula of UPCMLD0ENAT0507-5179:001?
The molecular formula of UPCMLD0ENAT0507-5179:001 is C16H13ClN2OS3.
What is the molecular weight of UPCMLD0ENAT0507-5179:001?
The molecular weight of UPCMLD0ENAT0507-5179:001 is 379.99 g/mol.
Where can I buy UPCMLD0ENAT0507-5179:001?
You can request a quote for UPCMLD0ENAT0507-5179:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0507-5179:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0507-5179:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.