5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-
TL;DR: 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)- (CAS 116564-78-4) is a chemical compound with molecular formula C15H18N2O3S and molecular weight 306.10382 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3-dimethoxy-6-methylsulfanyl-5,6,6a,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
Also Known As: 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-, 2,3-dimethoxy-6-methylsulfanyl-5,6,6a,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one, 7,8-Dimethoxy-11-(methylsulfanyl)-3,10,11,11a-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-5-one
Technical Specifications
| Molecular Formula | C15H18N2O3S |
| Molecular Weight | 306.10382 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.10382 Da |
| Heavy Atoms | 21 |
| Complexity | 431.0 |
| SMILES | COC1=C(C=C2C(=C1)C(=O)N3CC=CC3C(N2)SC)OC |
| InChIKey | IEVRMJPGCYEQSC-UHFFFAOYSA-N |
Chemical Property Profile of 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-
Property Insights of 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-. Following Lipinski's Rule of Five, 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)- 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
What is the CAS number of 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-?
The CAS number of 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)- is 116564-78-4.
What is the molecular formula of 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-?
The molecular formula of 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)- is C15H18N2O3S.
What is the molecular weight of 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-?
The molecular weight of 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)- is 306.10382 g/mol.
Where can I buy 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-?
You can request a quote for 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)-?
Yes, CoreyChem provides custom synthesis services for 5H-Pyrrolo(2,1-c)(1,4)benzodiazepin-5-one, 3,10,11,11a-tetrahydro-7,8-dimethoxy-11-methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.