BAS 00024464
TL;DR: BAS 00024464 (CAS 299962-57-5) is a chemical compound with molecular formula C15H18N2O3S and molecular weight 306.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-methyl-2-oxo-6-thia-1,8-diazatricyclo[7.5.0.03,7]tetradeca-3(7),4,8-triene-5-carboxylate
Also Known As: BAS 00024464, ethyl 3-methyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxylate, 3-methyl-4-oxo-7,8,9,10-tetrahydro-6H-thieno[1,2]pyrimido[4,5-a]azepine-2-carboxylic acid ethyl ester, 4-keto-3-methyl-7,8,9,10-tetrahydro-6H-thieno[1,2]pyrimid[4,5-a]azepine-2-carboxylic acid ethyl ester, ethyl 3-methyl-4-oxidanylidene-7,8,9,10-tetrahydro-6H-thieno[1,2]pyrimido[4,5-a]azepine-2-carboxylate
| Molecular Formula | C15H18N2O3S |
|---|---|
| Molecular Weight | 306.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 87.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.10382 |
| Heavy Atoms | 21 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 299962-57-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(S1)N=C3CCCCCN3C2=O)C |
| InChIKey | DJUGBFJEOXZGJP-UHFFFAOYSA-N |
Product Overview
BAS 00024464 (CAS 299962-57-5), with molecular formula C15H18N2O3S and molecular weight 306.10 g/mol. IUPAC: ethyl 4-methyl-2-oxo-6-thia-1,8-diazatricyclo[7.5.0.03,7]tetradeca-3(7),4,8-triene-5-carboxylate.
Chemical Property Profile of BAS 00024464
Property Insights of BAS 00024464
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00024464. The TPSA of 87.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00024464. Following Lipinski's Rule of Five, BAS 00024464 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 00024464?
The CAS number of BAS 00024464 is 299962-57-5.
What is the molecular formula of BAS 00024464?
The molecular formula of BAS 00024464 is C15H18N2O3S.
What is the molecular weight of BAS 00024464?
The molecular weight of BAS 00024464 is 306.10 g/mol.
Where can I buy BAS 00024464?
You can request a quote for BAS 00024464 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00024464?
Yes, KEHONG BIO provides custom synthesis services for BAS 00024464 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.