UPCMLD0ENAT0503-6624:001
TL;DR: UPCMLD0ENAT0503-6624:001 (CAS 6546-44-7) is a chemical compound with molecular formula C29H19ClIN5O and molecular weight 615.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-1-phenylpyrazole-4-carboxamide
Also Known As: UPCMLD0ENAT0503-6624:001, T0503-6624, 3-(4-chlorophenyl)-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-1-phenylpyrazole-4-carboxamide, 3-(4-Chlorophenyl)-N-[(6Z)-2-iodopyrido[1,2-b][2,4]benzodiazepin-6(11H)-ylidene]-1-phenyl-1H-pyrazole-4-carboxamide
| Molecular Formula | C29H19ClIN5O |
|---|---|
| Molecular Weight | 615.03 g/mol |
| LogP | 6.84 |
| Topological Polar Surface Area | 62.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 615.0323 |
| Heavy Atoms | 37 |
| Complexity | 1634.5298 |
Chemical Identifiers
| CAS Number | 6546-44-7 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=NC(=O)C3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5)N=C6N1C=C(C=C6)I |
Product Overview
UPCMLD0ENAT0503-6624:001 (CAS 6546-44-7), with molecular formula C29H19ClIN5O and molecular weight 615.03 g/mol. IUPAC: 3-(4-chlorophenyl)-N-(2-iodo-11H-pyrido[1,2-b][2,4]benzodiazepin-6-ylidene)-1-phenylpyrazole-4-carboxamide.
Chemical Property Profile of UPCMLD0ENAT0503-6624:001
Property Insights of UPCMLD0ENAT0503-6624:001
The XLogP value of 6.84 indicates that UPCMLD0ENAT0503-6624:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.85 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0503-6624:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0503-6624:001 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT0503-6624:001?
The CAS number of UPCMLD0ENAT0503-6624:001 is 6546-44-7.
What is the molecular formula of UPCMLD0ENAT0503-6624:001?
The molecular formula of UPCMLD0ENAT0503-6624:001 is C29H19ClIN5O.
What is the molecular weight of UPCMLD0ENAT0503-6624:001?
The molecular weight of UPCMLD0ENAT0503-6624:001 is 615.03 g/mol.
Where can I buy UPCMLD0ENAT0503-6624:001?
You can request a quote for UPCMLD0ENAT0503-6624:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0503-6624:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0503-6624:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.