![5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione structure](/static/products/902/902022-20-2.png)
5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione (CAS 902022-20-2) is a chemical compound with molecular formula C23H24N4O5 and molecular weight 436.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(3,4-dimethoxyphenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione
Also Known As: 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione, 5-[2-(3,4-dimethoxyphenyl)-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-ylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione, 5-[4-(3,4-dimethoxyphenyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-ylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C23H24N4O5 |
|---|---|
| Molecular Weight | 436.17 g/mol |
| LogP | 2.4845 |
| Topological Polar Surface Area | 107.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.17468 |
| Heavy Atoms | 32 |
| Complexity | 1339.189 |
Chemical Identifiers
| CAS Number | 902022-20-2 |
|---|---|
| SMILES | CN1C(=C(C(=O)N(C1=O)C)C2=NC3=CC=CC=C3NC(C2)C4=CC(=C(C=C4)OC)OC)O |
Product Overview
5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione (CAS 902022-20-2), with molecular formula C23H24N4O5 and molecular weight 436.17 g/mol. IUPAC: 5-[2-(3,4-dimethoxyphenyl)-2,3-dihydro-1H-1,5-benzodiazepin-4-yl]-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.4845 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 107.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione has 2 hydrogen bond donor(s) and 7 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 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione is 902022-20-2.
What is the molecular formula of 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione is C23H24N4O5.
What is the molecular weight of 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione is 436.17 g/mol.
Where can I buy 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-ylidene)-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.