BAS 04995718
TL;DR: BAS 04995718 (CAS 618079-72-4) is a chemical compound with molecular formula C20H18N6O2 and molecular weight 374.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-ethyl-6-imino-2-oxo-N-(pyridin-3-ylmethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide
Also Known As: BAS 04995718, 1-ethyl-2-imino-5-oxo-N-(pyridin-3-ylmethyl)-2,5-dihydro-1H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide, F1525-0240, 1-ETHYL-2-IMINO-5-OXO-N-(3-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXAMIDE, 1-ethyl-2-imino-5-oxo-N-(pyridin-3-ylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide
| Molecular Formula | C20H18N6O2 |
|---|---|
| Molecular Weight | 374.15 g/mol |
| LogP | 1.47357 |
| Topological Polar Surface Area | 105.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 374.1491 |
| Heavy Atoms | 28 |
| Complexity | 1307.5768 |
Chemical Identifiers
| CAS Number | 618079-72-4 |
|---|---|
| SMILES | CCN1C2=C(C=C(C1=N)C(=O)NCC3=CN=CC=C3)C(=O)N4C=CC=CC4=N2 |
Product Overview
BAS 04995718 (CAS 618079-72-4), with molecular formula C20H18N6O2 and molecular weight 374.15 g/mol. IUPAC: 7-ethyl-6-imino-2-oxo-N-(pyridin-3-ylmethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide.
Chemical Property Profile of BAS 04995718
Property Insights of BAS 04995718
The XLogP value of 1.47357 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04995718. The TPSA of 105.14 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04995718. Following Lipinski's Rule of Five, BAS 04995718 has 2 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 04995718?
The CAS number of BAS 04995718 is 618079-72-4.
What is the molecular formula of BAS 04995718?
The molecular formula of BAS 04995718 is C20H18N6O2.
What is the molecular weight of BAS 04995718?
The molecular weight of BAS 04995718 is 374.15 g/mol.
Where can I buy BAS 04995718?
You can request a quote for BAS 04995718 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04995718?
Yes, KEHONG BIO provides custom synthesis services for BAS 04995718 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.