Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)
TL;DR: Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester) (CAS 148238-46-4) is a chemical compound with molecular formula C19H26N4O5 and molecular weight 390.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[11-(butylamino)-7-methoxy-12-methyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate
Also Known As: Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester), azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate(ester), [6-(Butylamino)-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl hydrogen carbonimidate, [6-(Butylamino)-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazirino[2',3':3,4]pyrrolo[1,2-a]indol-8-yl]methyl hydrogen carbonimidate
| Molecular Formula | C19H26N4O5 |
|---|---|
| Molecular Weight | 390.19 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 390.1903 |
| Heavy Atoms | 28 |
| Complexity | 819.0 |
Chemical Identifiers
| CAS Number | 148238-46-4 |
|---|---|
| SMILES | CCCCNC1=C(C(=O)C2=C(C1=O)C(C3(N2CC4C3N4)OC)COC(=O)N)C |
| InChIKey | MUMZSESJJXSLPZ-UHFFFAOYSA-N |
Product Overview
Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester) (CAS 148238-46-4), with molecular formula C19H26N4O5 and molecular weight 390.19 g/mol. IUPAC: [11-(butylamino)-7-methoxy-12-methyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl]methyl carbamate.
Chemical Property Profile of Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)
Property Insights of Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester). The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester). Following Lipinski's Rule of Five, Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester) has 3 hydrogen bond donor(s) and 8 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 Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)?
The CAS number of Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester) is 148238-46-4.
What is the molecular formula of Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)?
The molecular formula of Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester) is C19H26N4O5.
What is the molecular weight of Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)?
The molecular weight of Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester) is 390.19 g/mol.
Where can I buy Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)?
You can request a quote for Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester)?
Yes, KEHONG BIO provides custom synthesis services for Azirino(2',3':3,4)pyrrolo(1,2-a)indole-4,7-dione, 1,1a,2,8,8a,8b-hexahydro-6-(butylamino)-8-(hydroxymethyl)-8a-methoxy-5-methyl-, carbamate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.