1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-
TL;DR: 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl- (CAS 117007-34-8) is a chemical compound with molecular formula C12H8N4OS and molecular weight 256.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-methyl-14-thia-8,11,12,16-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6,12,15-hexaen-10-one
Also Known As: 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-, 2-Methyl-1,3,4-thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-Methyl-3-thia-1,4,9,10a-tetraazacyclopenta[b]fluoren-10(9H)-one, 2-Methyl[1,3,4]thiadiazolo[3',2':1,2]pyrimido[5,4-b]indol-5(6H)-one, 13-methyl-14-thia-8,11,12,16-tetraazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6,12,15-hexaen-10-one
| Molecular Formula | C12H8N4OS |
|---|---|
| Molecular Weight | 256.04 g/mol |
| LogP | 2.09392 |
| Topological Polar Surface Area | 63.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 256.04187 |
| Heavy Atoms | 18 |
| Complexity | 962.60126 |
Chemical Identifiers
| CAS Number | 117007-34-8 |
|---|---|
| SMILES | CC1=NN2C(=O)C3=C(C4=CC=CC=C4N3)N=C2S1 |
Product Overview
1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl- (CAS 117007-34-8), with molecular formula C12H8N4OS and molecular weight 256.04 g/mol. IUPAC: 13-methyl-14-thia-8,11,12,16-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6,12,15-hexaen-10-one.
Chemical Property Profile of 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-
Property Insights of 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-
The XLogP value of 2.09392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-. The TPSA of 63.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-. Following Lipinski's Rule of Five, 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl- 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 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-?
The CAS number of 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl- is 117007-34-8.
What is the molecular formula of 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-?
The molecular formula of 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl- is C12H8N4OS.
What is the molecular weight of 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-?
The molecular weight of 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl- is 256.04 g/mol.
Where can I buy 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-?
You can request a quote for 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Thiadiazolo(3',2':1,2)pyrimido(5,4-b)indol-5(6H)-one, 2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.