4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-
TL;DR: 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)- (CAS 136364-78-8) is a chemical compound with molecular formula C16H13N3O2S and molecular weight 311.07285 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-(4-nitrophenyl)-5-thia-1,8-diazatricyclo[8.3.0.02,6]trideca-2(6),3,10,12-tetraene
Also Known As: 5,6-Dihydro-6-(4-nitrophenyl)-4H-pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-, 6-(4-Nitrophenyl)-5,6-dihydro-4H-pyrrolo[1,2-a]thieno[2,3-f][1,4]diazepine, 9-(4-nitrophenyl)-5-thia-1,8-diazatricyclo[8.3.0.02,6]trideca-2(6),3,10,12-tetraene, BRN 4846043
Technical Specifications
| Molecular Formula | C16H13N3O2S |
| Molecular Weight | 311.07285 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 91.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 311.07285 Da |
| Heavy Atoms | 22 |
| Complexity | 422.0 |
| SMILES | C1C2=C(C=CS2)N3C=CC=C3C(N1)C4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | GVZUZLRQDWBKEQ-UHFFFAOYSA-N |
Chemical Property Profile of 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-
Property Insights of 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-. The TPSA of 91.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-. Following Lipinski's Rule of Five, 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)- 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
What is the CAS number of 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-?
The CAS number of 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)- is 136364-78-8.
What is the molecular formula of 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-?
The molecular formula of 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)- is C16H13N3O2S.
What is the molecular weight of 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-?
The molecular weight of 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)- is 311.07285 g/mol.
Where can I buy 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-?
You can request a quote for 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)-?
Yes, CoreyChem provides custom synthesis services for 4H-Pyrrolo(1,2-a)thieno(2,3-f)(1,4)diazepine, 5,6-dihydro-6-(4-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.