BAS 04995255
TL;DR: BAS 04995255 (CAS 797814-56-3) is a chemical compound with molecular formula C22H20N4O3 and molecular weight 388.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-imino-13-methyl-2-oxo-7-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate
Also Known As: BAS 04995255, methyl 6-imino-13-methyl-2-oxo-7-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate, methyl 2-imino-8-methyl-5-oxo-1-(2-phenylethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate, METHYL 2-IMINO-8-METHYL-5-OXO-1-PHENETHYL-1,5-DIHYDRO-2H-DIPYRIDO[1,2-A:2,3-D]PYRIMIDINE-3-CARBOXYLATE
| Molecular Formula | C22H20N4O3 |
|---|---|
| Molecular Weight | 388.15 g/mol |
| LogP | 2.46639 |
| Topological Polar Surface Area | 89.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.15353 |
| Heavy Atoms | 29 |
| Complexity | 1354.104 |
Chemical Identifiers
| CAS Number | 797814-56-3 |
|---|---|
| SMILES | CC1=CN2C(=NC3=C(C2=O)C=C(C(=N)N3CCC4=CC=CC=C4)C(=O)OC)C=C1 |
Product Overview
BAS 04995255 (CAS 797814-56-3), with molecular formula C22H20N4O3 and molecular weight 388.15 g/mol. IUPAC: methyl 6-imino-13-methyl-2-oxo-7-(2-phenylethyl)-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carboxylate.
Chemical Property Profile of BAS 04995255
Property Insights of BAS 04995255
The XLogP value of 2.46639 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04995255. The TPSA of 89.45 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04995255. Following Lipinski's Rule of Five, BAS 04995255 has 1 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 04995255?
The CAS number of BAS 04995255 is 797814-56-3.
What is the molecular formula of BAS 04995255?
The molecular formula of BAS 04995255 is C22H20N4O3.
What is the molecular weight of BAS 04995255?
The molecular weight of BAS 04995255 is 388.15 g/mol.
Where can I buy BAS 04995255?
You can request a quote for BAS 04995255 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04995255?
Yes, KEHONG BIO provides custom synthesis services for BAS 04995255 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.