C30H34N4O3
TL;DR: C30H34N4O3 (CAS 956962-45-1) is a chemical compound with molecular formula C30H34N4O3 and molecular weight 498.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,9S)-6-oxo-N-[(2S)-1-oxo-3-phenyl-1-(4-propan-2-ylanilino)propan-2-yl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide
Also Known As: (1R,5R)-N-((S)-1-((4-isopropylphenyl)amino)-1-oxo-3-phenylpropan-2-yl)-8-oxo-4,5,6,8-tetrahydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(2H)-carboxamide, (1S,5S)-8-oxo-N-[(2S)-1-oxo-3-phenyl-1-{[4-(propan-2-yl)phenyl]amino}propan-2-yl]-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
| Molecular Formula | C30H34N4O3 |
|---|---|
| Molecular Weight | 498.26 g/mol |
| LogP | 4.3504 |
| Topological Polar Surface Area | 83.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 498.2631 |
| Heavy Atoms | 37 |
| Complexity | 1316.6581 |
Chemical Identifiers
| CAS Number | 956962-45-1 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)N3C[C@H]4C[C@@H](C3)C5=CC=CC(=O)N5C4 |
Product Overview
C30H34N4O3 (CAS 956962-45-1), with molecular formula C30H34N4O3 and molecular weight 498.26 g/mol. IUPAC: (1S,9S)-6-oxo-N-[(2S)-1-oxo-3-phenyl-1-(4-propan-2-ylanilino)propan-2-yl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide.
Chemical Property Profile of C30H34N4O3
Property Insights of C30H34N4O3
The XLogP value of 4.3504 indicates that C30H34N4O3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.44 Ų falls within the moderate polarity range, balancing permeability and solubility for C30H34N4O3. Following Lipinski's Rule of Five, C30H34N4O3 has 2 hydrogen bond donor(s) and 3 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 C30H34N4O3?
The CAS number of C30H34N4O3 is 956962-45-1.
What is the molecular formula of C30H34N4O3?
The molecular formula of C30H34N4O3 is C30H34N4O3.
What is the molecular weight of C30H34N4O3?
The molecular weight of C30H34N4O3 is 498.26 g/mol.
Where can I buy C30H34N4O3?
You can request a quote for C30H34N4O3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C30H34N4O3?
Yes, KEHONG BIO provides custom synthesis services for C30H34N4O3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.