(2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1)
TL;DR: (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1) (CAS 30462-38-5) is a chemical compound with molecular formula C24H28N2O4 and molecular weight 408.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(11-azatetracyclo[10.4.0.02,4.05,10]hexadeca-1(16),5,7,9,12,14-hexaen-11-yl)-N,N-dimethylpropan-1-amine;(Z)-but-2-enedioic acid
Also Known As: (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1), 3-(11-azatetracyclo[10.4.0.02,4.05,10]hexadeca-1(16),5,7,9,12,14-hexaen-11-yl)-N,N-dimethylpropan-1-amine;(Z)-but-2-enedioic acid
| Molecular Formula | C24H28N2O4 |
|---|---|
| Molecular Weight | 408.20 g/mol |
| LogP | 4.0727 |
| Topological Polar Surface Area | 81.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.2049 |
| Heavy Atoms | 30 |
| Complexity | 870.8081 |
Chemical Identifiers
| CAS Number | 30462-38-5 |
|---|---|
| SMILES | CN(C)CCCN1C2=CC=CC=C2C3CC3C4=CC=CC=C41.C(=C\C(=O)O)\C(=O)O |
Product Overview
(2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1) (CAS 30462-38-5), with molecular formula C24H28N2O4 and molecular weight 408.20 g/mol. IUPAC: 3-(11-azatetracyclo[10.4.0.02,4.05,10]hexadeca-1(16),5,7,9,12,14-hexaen-11-yl)-N,N-dimethylpropan-1-amine;(Z)-but-2-enedioic acid.
Chemical Property Profile of (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1)
Property Insights of (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1)
The XLogP value of 4.0727 indicates that (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.08 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1). Following Lipinski's Rule of Five, (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1) has 2 hydrogen bond donor(s) and 4 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 (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1)?
The CAS number of (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1) is 30462-38-5.
What is the molecular formula of (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1)?
The molecular formula of (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1) is C24H28N2O4.
What is the molecular weight of (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1)?
The molecular weight of (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1) is 408.20 g/mol.
Where can I buy (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1)?
You can request a quote for (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1)?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-But-2-enedioic acid--3-(1a,10b-dihydrodibenzo[b,f]cyclopropa[d]azepin-6(1H)-yl)-N,N-dimethylpropan-1-amine (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.