BAS 00609382
TL;DR: BAS 00609382 (CAS 331837-87-7) is a chemical compound with molecular formula C16H13N5OS and molecular weight 323.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-phenyl-16-thia-2,3,4,5,7-pentazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Also Known As: BAS 00609382, BRD-K96333017-001-01-4, 4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetraazolo[1,5-a]pyrimidin-5(4H)-one, 4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one, 4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one
| Molecular Formula | C16H13N5OS |
|---|---|
| Molecular Weight | 323.08 g/mol |
| LogP | 2.3687 |
| Topological Polar Surface Area | 65.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 323.08408 |
| Heavy Atoms | 23 |
| Complexity | 1092.5057 |
Chemical Identifiers
| CAS Number | 331837-87-7 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N4C(=NN=N4)N(C3=O)C5=CC=CC=C5 |
Product Overview
BAS 00609382 (CAS 331837-87-7), with molecular formula C16H13N5OS and molecular weight 323.08 g/mol. IUPAC: 7-phenyl-16-thia-2,3,4,5,7-pentazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one.
Chemical Property Profile of BAS 00609382
Property Insights of BAS 00609382
The XLogP value of 2.3687 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00609382. The TPSA of 65.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00609382. Following Lipinski's Rule of Five, BAS 00609382 has 0 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 BAS 00609382?
The CAS number of BAS 00609382 is 331837-87-7.
What is the molecular formula of BAS 00609382?
The molecular formula of BAS 00609382 is C16H13N5OS.
What is the molecular weight of BAS 00609382?
The molecular weight of BAS 00609382 is 323.08 g/mol.
Where can I buy BAS 00609382?
You can request a quote for BAS 00609382 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00609382?
Yes, KEHONG BIO provides custom synthesis services for BAS 00609382 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.