Amphibine D
TL;DR: Amphibine D (CAS 38496-02-5) is a chemical compound with molecular formula C36H49N5O5 and molecular weight 631.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-[(13Z)-10-butan-2-yl-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.2.2.03,7]nonadeca-1(17),13,15,18-tetraen-6-yl]-3-methyl-1-oxopentan-2-yl]-2-(dimethylamino)-3-phenylpropanamide
Also Known As: Amphibine D, amphibine-D, Amphibin D, Benzenepropanamide, .alpha.-(dimethylamino)-N-[2-methyl-1-[[3,3a,11,12,13,14,15,15a-octahydro-13-(1-methylpropyl)-12,15-dioxo-5,8-ethenopyrrolo[3,2-b][1,5,8]oxadiazacyclotetradecin-1(2H)-yl]carbonyl]butyl]-, 1-[2-[2- -3-phenylpropanoylamino]-3-methylpentanoyl]-2,3,3a,13,14,15a-hexahydro-13- -5,8-ethenopyrrolo[3,2-b][1,5,8]oxadiazacyclotetradecine-12,15 -dione
| Molecular Formula | C36H49N5O5 |
|---|---|
| Molecular Weight | 631.37 g/mol |
| LogP | 3.3701 |
| Topological Polar Surface Area | 120.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 631.37335 |
| Heavy Atoms | 46 |
| Complexity | 1378.9142 |
Chemical Identifiers
| CAS Number | 38496-02-5 |
|---|---|
| SMILES | CCC(C)C1C(=O)N/C=C\C2=CC=C(C=C2)OC3CCN(C3C(=O)N1)C(=O)C(C(C)CC)NC(=O)C(CC4=CC=CC=C4)N(C)C |
Product Overview
Amphibine D (CAS 38496-02-5), with molecular formula C36H49N5O5 and molecular weight 631.37 g/mol. IUPAC: N-[1-[(13Z)-10-butan-2-yl-8,11-dioxo-2-oxa-6,9,12-triazatricyclo[13.2.2.03,7]nonadeca-1(17),13,15,18-tetraen-6-yl]-3-methyl-1-oxopentan-2-yl]-2-(dimethylamino)-3-phenylpropanamide.
Chemical Property Profile of Amphibine D
Property Insights of Amphibine D
The XLogP value of 3.3701 indicates that Amphibine D is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Amphibine D. Following Lipinski's Rule of Five, Amphibine D has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Amphibine D?
The CAS number of Amphibine D is 38496-02-5.
What is the molecular formula of Amphibine D?
The molecular formula of Amphibine D is C36H49N5O5.
What is the molecular weight of Amphibine D?
The molecular weight of Amphibine D is 631.37 g/mol.
Where can I buy Amphibine D?
You can request a quote for Amphibine D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amphibine D?
Yes, KEHONG BIO provides custom synthesis services for Amphibine D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.