D0M1BF
TL;DR: D0M1BF (CAS 229952-21-0) is a chemical compound with molecular formula C29H26N4O and molecular weight 446.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-(naphthalen-1-ylmethyl)indole-2-carboxamide
Also Known As: 3-amidinobenzylindole carboxamide 23, N-ethyl-4-methoxy-benzenemethanamine, J2.089.128I, S-6716, 1-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-(naphthalen-1-ylmethyl)indole-2-carboxamide
| Molecular Formula | C29H26N4O |
|---|---|
| Molecular Weight | 446.21 g/mol |
| LogP | 5.36529 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.21066 |
| Heavy Atoms | 34 |
| Complexity | 1541.6752 |
Chemical Identifiers
| CAS Number | 229952-21-0 |
|---|---|
| SMILES | CC1=C2C=C(N(C2=CC=C1)CC3=CC(=CC=C3)C(=N)N)C(=O)NCC4=CC=CC5=CC=CC=C54 |
Product Overview
D0M1BF (CAS 229952-21-0), with molecular formula C29H26N4O and molecular weight 446.21 g/mol. IUPAC: 1-[(3-carbamimidoylphenyl)methyl]-4-methyl-N-(naphthalen-1-ylmethyl)indole-2-carboxamide.
Chemical Property Profile of D0M1BF
Property Insights of D0M1BF
The XLogP value of 5.36529 indicates that D0M1BF is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for D0M1BF. Following Lipinski's Rule of Five, D0M1BF has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of D0M1BF?
The CAS number of D0M1BF is 229952-21-0.
What is the molecular formula of D0M1BF?
The molecular formula of D0M1BF is C29H26N4O.
What is the molecular weight of D0M1BF?
The molecular weight of D0M1BF is 446.21 g/mol.
Where can I buy D0M1BF?
You can request a quote for D0M1BF directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D0M1BF?
Yes, KEHONG BIO provides custom synthesis services for D0M1BF and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.