C24H31N5O2S
TL;DR: C24H31N5O2S (CAS 846599-25-5) is a chemical compound with molecular formula C24H31N5O2S and molecular weight 453.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-13-(2-methylpiperidin-1-yl)-8-morpholin-4-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene
Also Known As: 2,2-dimethyl-8-(2-methylpiperidin-1-yl)-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 2,2-dimethyl-8-(2-methylpiperidin-1-yl)-5-morpholino-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
| Molecular Formula | C24H31N5O2S |
|---|---|
| Molecular Weight | 453.22 g/mol |
| LogP | 4.3062 |
| Topological Polar Surface Area | 63.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 453.21985 |
| Heavy Atoms | 32 |
| Complexity | 1170.3564 |
Chemical Identifiers
| CAS Number | 846599-25-5 |
|---|---|
| SMILES | CC1CCCCN1C2=NC=NC3=C2SC4=C3C5=C(COC(C5)(C)C)C(=N4)N6CCOCC6 |
Product Overview
C24H31N5O2S (CAS 846599-25-5), with molecular formula C24H31N5O2S and molecular weight 453.22 g/mol. IUPAC: 4,4-dimethyl-13-(2-methylpiperidin-1-yl)-8-morpholin-4-yl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene.
Chemical Property Profile of C24H31N5O2S
Property Insights of C24H31N5O2S
The XLogP value of 4.3062 indicates that C24H31N5O2S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.61 Ų falls within the moderate polarity range, balancing permeability and solubility for C24H31N5O2S. Following Lipinski's Rule of Five, C24H31N5O2S has 0 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 C24H31N5O2S?
The CAS number of C24H31N5O2S is 846599-25-5.
What is the molecular formula of C24H31N5O2S?
The molecular formula of C24H31N5O2S is C24H31N5O2S.
What is the molecular weight of C24H31N5O2S?
The molecular weight of C24H31N5O2S is 453.22 g/mol.
Where can I buy C24H31N5O2S?
You can request a quote for C24H31N5O2S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C24H31N5O2S?
Yes, KEHONG BIO provides custom synthesis services for C24H31N5O2S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.