ChemDiv2_002255
TL;DR: ChemDiv2_002255 (CAS 304433-18-9) is a chemical compound with molecular formula C17H15N5O2S and molecular weight 353.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-7-phenyl-13-oxa-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: ChemDiv2_002255, AE-848/31942011, A1304/0059279, 7,7-dimethyl-4-phenyl-6,7-dihydro-4H-pyrano[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(9H)-one, 7,7-dimethyl-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,3,4]tetraazolo[1,5-a]pyrimidin-5(4H)-one
| Molecular Formula | C17H15N5O2S |
|---|---|
| Molecular Weight | 353.09 g/mol |
| LogP | 2.3412 |
| Topological Polar Surface Area | 74.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 353.09464 |
| Heavy Atoms | 25 |
| Complexity | 1172.6554 |
Chemical Identifiers
| CAS Number | 304433-18-9 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=NN34)C5=CC=CC=C5)C |
Product Overview
ChemDiv2_002255 (CAS 304433-18-9), with molecular formula C17H15N5O2S and molecular weight 353.09 g/mol. IUPAC: 12,12-dimethyl-7-phenyl-13-oxa-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 ChemDiv2_002255
Property Insights of ChemDiv2_002255
The XLogP value of 2.3412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_002255. The TPSA of 74.31 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_002255. Following Lipinski's Rule of Five, ChemDiv2_002255 has 0 hydrogen bond donor(s) and 6 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 ChemDiv2_002255?
The CAS number of ChemDiv2_002255 is 304433-18-9.
What is the molecular formula of ChemDiv2_002255?
The molecular formula of ChemDiv2_002255 is C17H15N5O2S.
What is the molecular weight of ChemDiv2_002255?
The molecular weight of ChemDiv2_002255 is 353.09 g/mol.
Where can I buy ChemDiv2_002255?
You can request a quote for ChemDiv2_002255 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_002255?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_002255 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.