UPCMLD0ENAT0507-6030:001
TL;DR: UPCMLD0ENAT0507-6030:001 (CAS 379253-98-2) is a chemical compound with molecular formula C24H20N4OS3 and molecular weight 476.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
Also Known As: UPCMLD0ENAT0507-6030:001, AF-399/15539223, N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide, N-(3-cyano(4,5,6,7,8-pentahydrocyclohepta[1,2-d]thiophen-2-yl))-2-(6-phenylthi opheno[3,2-e]pyrimidin-4-ylthio)acetamide, N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thien-2-yl)-2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
| Molecular Formula | C24H20N4OS3 |
|---|---|
| Molecular Weight | 476.08 g/mol |
| LogP | 6.29118 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 476.07993 |
| Heavy Atoms | 32 |
| Complexity | 1320.5165 |
Chemical Identifiers
| CAS Number | 379253-98-2 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CSC3=NC=NC4=C3C=C(S4)C5=CC=CC=C5 |
Product Overview
UPCMLD0ENAT0507-6030:001 (CAS 379253-98-2), with molecular formula C24H20N4OS3 and molecular weight 476.08 g/mol. IUPAC: N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide.
Chemical Property Profile of UPCMLD0ENAT0507-6030:001
Property Insights of UPCMLD0ENAT0507-6030:001
The XLogP value of 6.29118 indicates that UPCMLD0ENAT0507-6030:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0507-6030:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0507-6030:001 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT0507-6030:001?
The CAS number of UPCMLD0ENAT0507-6030:001 is 379253-98-2.
What is the molecular formula of UPCMLD0ENAT0507-6030:001?
The molecular formula of UPCMLD0ENAT0507-6030:001 is C24H20N4OS3.
What is the molecular weight of UPCMLD0ENAT0507-6030:001?
The molecular weight of UPCMLD0ENAT0507-6030:001 is 476.08 g/mol.
Where can I buy UPCMLD0ENAT0507-6030:001?
You can request a quote for UPCMLD0ENAT0507-6030:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0507-6030:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0507-6030:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.