10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one
TL;DR: 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one (CAS 137987-38-3) is a chemical compound with molecular formula C19H19N3O3 and molecular weight 337.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,4-dimethoxyphenyl)-2,4,5,10-tetrahydro-1H-pyrrolo[3,4-c][1,5]benzodiazepin-3-one
Also Known As: 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one, AH-262/08501016, Pyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one, 3,4,9,10-tetrahydro-10-(3,4-dimethoxyphenyl)-, dihydrate, 10-(3,4-dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo[3,4-b][1,5]benzodiazepin-1(2H)-one, 4-(3,4-dimethoxyphenyl)-2,4,5,10-tetrahydro-1H-pyrrolo[3,4-c][1,5]benzodiazepin-3-one
| Molecular Formula | C19H19N3O3 |
|---|---|
| Molecular Weight | 337.14 g/mol |
| LogP | 2.6664 |
| Topological Polar Surface Area | 71.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.14264 |
| Heavy Atoms | 25 |
| Complexity | 875.9681 |
Chemical Identifiers
| CAS Number | 137987-38-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2C3=C(CNC3=O)NC4=CC=CC=C4N2)OC |
Product Overview
10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one (CAS 137987-38-3), with molecular formula C19H19N3O3 and molecular weight 337.14 g/mol. IUPAC: 4-(3,4-dimethoxyphenyl)-2,4,5,10-tetrahydro-1H-pyrrolo[3,4-c][1,5]benzodiazepin-3-one.
Chemical Property Profile of 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one
Property Insights of 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one
The XLogP value of 2.6664 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one. The TPSA of 71.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one. Following Lipinski's Rule of Five, 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one has 3 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 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one?
The CAS number of 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one is 137987-38-3.
What is the molecular formula of 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one?
The molecular formula of 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one is C19H19N3O3.
What is the molecular weight of 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one?
The molecular weight of 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one is 337.14 g/mol.
Where can I buy 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one?
You can request a quote for 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 10-(3,4-Dimethoxyphenyl)-3,4,9,10-tetrahydropyrrolo(3,4-b)(1,5)benzodiazepin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.