UPCMLD0ENAT0513-5441:001
TL;DR: UPCMLD0ENAT0513-5441:001 (CAS 354130-19-1) is a chemical compound with molecular formula C17H15N3OS2 and molecular weight 341.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetamide
Also Known As: UPCMLD0ENAT0513-5441:001, 2-(6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-ylsulfanyl)-N-phenylacetamide, AO-364/37357119, N-phenyl-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetamide, N-phenyl-2-(5,6,7-trihydrocyclopenta[1,2-d]pyrimidino[4,5-b]thiophen-4-ylthio) acetamide
| Molecular Formula | C17H15N3OS2 |
|---|---|
| Molecular Weight | 341.07 g/mol |
| LogP | 3.9108 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.06564 |
| Heavy Atoms | 23 |
| Complexity | 860.9059 |
Chemical Identifiers
| CAS Number | 354130-19-1 |
|---|---|
| SMILES | C1CC2=C(C1)SC3=C2C(=NC=N3)SCC(=O)NC4=CC=CC=C4 |
Product Overview
UPCMLD0ENAT0513-5441:001 (CAS 354130-19-1), with molecular formula C17H15N3OS2 and molecular weight 341.07 g/mol. IUPAC: N-phenyl-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetamide.
Chemical Property Profile of UPCMLD0ENAT0513-5441:001
Property Insights of UPCMLD0ENAT0513-5441:001
The XLogP value of 3.9108 indicates that UPCMLD0ENAT0513-5441:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, UPCMLD0ENAT0513-5441:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0513-5441:001 has 1 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 UPCMLD0ENAT0513-5441:001?
The CAS number of UPCMLD0ENAT0513-5441:001 is 354130-19-1.
What is the molecular formula of UPCMLD0ENAT0513-5441:001?
The molecular formula of UPCMLD0ENAT0513-5441:001 is C17H15N3OS2.
What is the molecular weight of UPCMLD0ENAT0513-5441:001?
The molecular weight of UPCMLD0ENAT0513-5441:001 is 341.07 g/mol.
Where can I buy UPCMLD0ENAT0513-5441:001?
You can request a quote for UPCMLD0ENAT0513-5441:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0513-5441:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0513-5441:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.