BAS 04801557
TL;DR: BAS 04801557 (CAS 450394-90-8) is a chemical compound with molecular formula C15H18N2O2S and molecular weight 290.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-3-(3-oxobutan-2-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: BAS 04801557, 5,6,7,8-Tetrahydro-7-methyl-3-(1-methyl-2-oxopropyl)[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 7-methyl-3-(3-oxobutan-2-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 7-Methyl-3-(3-oxobutan-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 7-methyl-3-(1-methyl-2-oxopropyl)-3,5,6,7,8-pentahydrobenzo[b]thiopheno[2,3-d] pyrimidin-4-one
| Molecular Formula | C15H18N2O2S |
|---|---|
| Molecular Weight | 290.11 g/mol |
| LogP | 2.7328 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.1089 |
| Heavy Atoms | 20 |
| Complexity | 744.14685 |
Chemical Identifiers
| CAS Number | 450394-90-8 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC3=C2C(=O)N(C=N3)C(C)C(=O)C |
Product Overview
BAS 04801557 (CAS 450394-90-8), with molecular formula C15H18N2O2S and molecular weight 290.11 g/mol. IUPAC: 7-methyl-3-(3-oxobutan-2-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of BAS 04801557
Property Insights of BAS 04801557
The XLogP value of 2.7328 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04801557. With a topological polar surface area (TPSA) of 51.96 Ų, BAS 04801557 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04801557 has 0 hydrogen bond donor(s) and 4 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 04801557?
The CAS number of BAS 04801557 is 450394-90-8.
What is the molecular formula of BAS 04801557?
The molecular formula of BAS 04801557 is C15H18N2O2S.
What is the molecular weight of BAS 04801557?
The molecular weight of BAS 04801557 is 290.11 g/mol.
Where can I buy BAS 04801557?
You can request a quote for BAS 04801557 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04801557?
Yes, KEHONG BIO provides custom synthesis services for BAS 04801557 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.