BIM-0032992.P001
TL;DR: BIM-0032992.P001 (CAS 6186-82-9) is a chemical compound with molecular formula C18H13N5O4S and molecular weight 395.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6Z)-2-ethyl-5-imino-6-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Also Known As: BIM-0032992.P001, (6Z)-2-ethyl-5-imino-6-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 2-ethyl-5-imino-6-{[5-(2-nitrophenyl)-2-furyl]methylene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, (6Z)-2-ethyl-5-imino-6-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, (Z)-2-ethyl-5-imino-6-((5-(2-nitrophenyl)furan-2-yl)methylene)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7(6H)-one
| Molecular Formula | C18H13N5O4S |
|---|---|
| Molecular Weight | 395.07 g/mol |
| LogP | 3.88397 |
| Topological Polar Surface Area | 125.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 395.06882 |
| Heavy Atoms | 28 |
| Complexity | 1114.6842 |
Chemical Identifiers
| CAS Number | 6186-82-9 |
|---|---|
| SMILES | CCC1=NN2C(=N)/C(=C/C3=CC=C(O3)C4=CC=CC=C4[N+](=O)[O-])/C(=O)N=C2S1 |
Product Overview
BIM-0032992.P001 (CAS 6186-82-9), with molecular formula C18H13N5O4S and molecular weight 395.07 g/mol. IUPAC: (6Z)-2-ethyl-5-imino-6-[[5-(2-nitrophenyl)furan-2-yl]methylidene]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one.
Chemical Property Profile of BIM-0032992.P001
Property Insights of BIM-0032992.P001
The XLogP value of 3.88397 indicates that BIM-0032992.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 125.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0032992.P001. Following Lipinski's Rule of Five, BIM-0032992.P001 has 1 hydrogen bond donor(s) and 7 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-0032992.P001?
The CAS number of BIM-0032992.P001 is 6186-82-9.
What is the molecular formula of BIM-0032992.P001?
The molecular formula of BIM-0032992.P001 is C18H13N5O4S.
What is the molecular weight of BIM-0032992.P001?
The molecular weight of BIM-0032992.P001 is 395.07 g/mol.
Where can I buy BIM-0032992.P001?
You can request a quote for BIM-0032992.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0032992.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0032992.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.