BAS 00297551
TL;DR: BAS 00297551 (CAS 330971-03-4) is a chemical compound with molecular formula C14H19N3OS and molecular weight 277.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-2-(2-methylpropyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: BAS 00297551, 3-amino-2-(2-methylpropyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 3-amino-2-(2-methylpropyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 3-Amino-2-isobutyl-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one, 3-amino-2-isobutyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C14H19N3OS |
|---|---|
| Molecular Weight | 277.12 g/mol |
| LogP | 2.2491 |
| Topological Polar Surface Area | 60.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.12488 |
| Heavy Atoms | 19 |
| Complexity | 684.0364 |
Chemical Identifiers
| CAS Number | 330971-03-4 |
|---|---|
| SMILES | CC(C)CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1N |
Product Overview
BAS 00297551 (CAS 330971-03-4), with molecular formula C14H19N3OS and molecular weight 277.12 g/mol. IUPAC: 3-amino-2-(2-methylpropyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of BAS 00297551
Property Insights of BAS 00297551
The XLogP value of 2.2491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00297551. The TPSA of 60.91 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00297551. Following Lipinski's Rule of Five, BAS 00297551 has 1 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 00297551?
The CAS number of BAS 00297551 is 330971-03-4.
What is the molecular formula of BAS 00297551?
The molecular formula of BAS 00297551 is C14H19N3OS.
What is the molecular weight of BAS 00297551?
The molecular weight of BAS 00297551 is 277.12 g/mol.
Where can I buy BAS 00297551?
You can request a quote for BAS 00297551 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00297551?
Yes, KEHONG BIO provides custom synthesis services for BAS 00297551 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.