Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl-
TL;DR: Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl- (CAS 57436-05-2) is a chemical compound with molecular formula C16H17N3O and molecular weight 267.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,6,7-trimethyl-5-phenyl-3H-pyrrolo[3,4-e][1,4]diazepin-2-one
Also Known As: Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl-, 3,7-Dihydro-5-phenyl-1,6,7-trimethylpyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 1,6,7-trimethyl-5-phenyl-3H-pyrrolo[3,4-e][1,4]diazepin-2-one, 1,6,7-trimethyl-5-phenyl-1H,2H,3H,7H-pyrrolo[3,4-e][1,4]diazepin-2-one, 1,6,7-Trimethyl-5-phenyl-3,7-dihydropyrrolo[3,4-e][1,4]diazepin-2(1H)-one
| Molecular Formula | C16H17N3O |
|---|---|
| Molecular Weight | 267.14 g/mol |
| LogP | 2.14732 |
| Topological Polar Surface Area | 37.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 267.13718 |
| Heavy Atoms | 20 |
| Complexity | 698.0121 |
Chemical Identifiers
| CAS Number | 57436-05-2 |
|---|---|
| SMILES | CC1=C2C(=CN1C)N(C(=O)CN=C2C3=CC=CC=C3)C |
Product Overview
Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl- (CAS 57436-05-2), with molecular formula C16H17N3O and molecular weight 267.14 g/mol. IUPAC: 1,6,7-trimethyl-5-phenyl-3H-pyrrolo[3,4-e][1,4]diazepin-2-one.
Chemical Property Profile of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl-
Property Insights of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl-
The XLogP value of 2.14732 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl-. With a topological polar surface area (TPSA) of 37.6 Ų, Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl- has 0 hydrogen bond donor(s) and 2 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 Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl-?
The CAS number of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl- is 57436-05-2.
What is the molecular formula of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl-?
The molecular formula of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl- is C16H17N3O.
What is the molecular weight of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl-?
The molecular weight of Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl- is 267.14 g/mol.
Where can I buy Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl-?
You can request a quote for Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolo(3,4-e)(1,4)diazepin-2(1H)-one, 3,7-dihydro-5-phenyl-1,6,7-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.