BIM-0047669.P001
TL;DR: BIM-0047669.P001 (CAS 380592-85-8) is a chemical compound with molecular formula C20H17N5O5S and molecular weight 439.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6Z)-5-imino-6-[[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene]-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: BIM-0047669.P001, (6Z)-5-imino-6-[[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene]-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, (6Z)-5-IMINO-6-{[5-(2-METHOXY-4-NITROPHENYL)FURAN-2-YL]METHYLIDENE}-2-(PROPAN-2-YL)-5H,6H,7H-[1,3,4]THIADIAZOLO[3,2-A]PYRIMIDIN-7-ONE, (Z)-5-imino-2-isopropyl-6-((5-(2-methoxy-4-nitrophenyl)furan-2-yl)methylene)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one
| Molecular Formula | C20H17N5O5S |
|---|---|
| Molecular Weight | 439.10 g/mol |
| LogP | 4.13857 |
| Topological Polar Surface Area | 134.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 439.09503 |
| Heavy Atoms | 31 |
| Complexity | 1210.2928 |
Chemical Identifiers
| CAS Number | 380592-85-8 |
|---|---|
| SMILES | CC(C)C1=NN2C(=N)/C(=C/C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])OC)/C(=O)N=C2S1 |
Product Overview
BIM-0047669.P001 (CAS 380592-85-8), with molecular formula C20H17N5O5S and molecular weight 439.10 g/mol. IUPAC: (6Z)-5-imino-6-[[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene]-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.
Chemical Property Profile of BIM-0047669.P001
Property Insights of BIM-0047669.P001
The XLogP value of 4.13857 indicates that BIM-0047669.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0047669.P001. Following Lipinski's Rule of Five, BIM-0047669.P001 has 1 hydrogen bond donor(s) and 8 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 BIM-0047669.P001?
The CAS number of BIM-0047669.P001 is 380592-85-8.
What is the molecular formula of BIM-0047669.P001?
The molecular formula of BIM-0047669.P001 is C20H17N5O5S.
What is the molecular weight of BIM-0047669.P001?
The molecular weight of BIM-0047669.P001 is 439.10 g/mol.
Where can I buy BIM-0047669.P001?
You can request a quote for BIM-0047669.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0047669.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0047669.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.