BIM-0012801.P001
TL;DR: BIM-0012801.P001 (CAS 351385-64-3) is a chemical compound with molecular formula C21H21N5O4S2 and molecular weight 471.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[7-(4-methoxyphenyl)-12,12-dimethyl-8-oxo-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]acetamide
Also Known As: BIM-0012801.P001, 2-((4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,9-tetrahydro-4H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)thio)acetamide, 2-{[4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide
| Molecular Formula | C21H21N5O4S2 |
|---|---|
| Molecular Weight | 471.10 g/mol |
| LogP | 2.5322 |
| Topological Polar Surface Area | 113.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 471.1035 |
| Heavy Atoms | 32 |
| Complexity | 1418.4989 |
Chemical Identifiers
| CAS Number | 351385-64-3 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)N)C5=CC=C(C=C5)OC)C |
Product Overview
BIM-0012801.P001 (CAS 351385-64-3), with molecular formula C21H21N5O4S2 and molecular weight 471.10 g/mol. IUPAC: 2-[[7-(4-methoxyphenyl)-12,12-dimethyl-8-oxo-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-3-yl]sulfanyl]acetamide.
Chemical Property Profile of BIM-0012801.P001
Property Insights of BIM-0012801.P001
The XLogP value of 2.5322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0012801.P001. The TPSA of 113.74 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0012801.P001. Following Lipinski's Rule of Five, BIM-0012801.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-0012801.P001?
The CAS number of BIM-0012801.P001 is 351385-64-3.
What is the molecular formula of BIM-0012801.P001?
The molecular formula of BIM-0012801.P001 is C21H21N5O4S2.
What is the molecular weight of BIM-0012801.P001?
The molecular weight of BIM-0012801.P001 is 471.10 g/mol.
Where can I buy BIM-0012801.P001?
You can request a quote for BIM-0012801.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0012801.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0012801.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.