BAS 00655312
TL;DR: BAS 00655312 (CAS 5714-63-6) is a chemical compound with molecular formula C19H21N3O and molecular weight 307.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(dimethylamino)phenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
Also Known As: BAS 00655312, AB00094471-01, 4-[4-(dimethylamino)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 4-[4-(DIMETHYLAMINO)PHENYL]-2-METHYL-5-OXO-4,6,7,8-TETRAHYDRO-1H-QUINOLINE-3-CARBONITRILE, 4-(4-dimethylaminophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
| Molecular Formula | C19H21N3O |
|---|---|
| Molecular Weight | 307.17 g/mol |
| LogP | 3.24408 |
| Topological Polar Surface Area | 56.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.16846 |
| Heavy Atoms | 23 |
| Complexity | 747.8146 |
Chemical Identifiers
| CAS Number | 5714-63-6 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)N(C)C)C#N |
Product Overview
BAS 00655312 (CAS 5714-63-6), with molecular formula C19H21N3O and molecular weight 307.17 g/mol. IUPAC: 4-[4-(dimethylamino)phenyl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile.
Chemical Property Profile of BAS 00655312
Property Insights of BAS 00655312
The XLogP value of 3.24408 indicates that BAS 00655312 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.13 Ų, BAS 00655312 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00655312 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 00655312?
The CAS number of BAS 00655312 is 5714-63-6.
What is the molecular formula of BAS 00655312?
The molecular formula of BAS 00655312 is C19H21N3O.
What is the molecular weight of BAS 00655312?
The molecular weight of BAS 00655312 is 307.17 g/mol.
Where can I buy BAS 00655312?
You can request a quote for BAS 00655312 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00655312?
Yes, KEHONG BIO provides custom synthesis services for BAS 00655312 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.