N(1),N(10)-Bis(4-nitrobenzoyl)spermidine
TL;DR: N(1),N(10)-Bis(4-nitrobenzoyl)spermidine (CAS 87581-14-4) is a chemical compound with molecular formula C21H25N5O6 and molecular weight 443.18048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-nitro-N-[4-[3-[(4-nitrobenzoyl)amino]propylamino]butyl]benzamide
Also Known As: B-4-Nbsd, FNT 1, N(1),N(10)-Bis(4-nitrobenzoyl)spermidine, 4-nitro-n-[3-({4-[(4-nitrobenzoyl)amino]butyl}amino)propyl]benzamide, 4-nitro-N-[4-[3-[(4-nitrobenzoyl)amino]propylamino]butyl]benzamide
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C21H25N5O6 |
| Molecular Weight | 443.18048 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 162.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 443.18048 Da |
| Heavy Atoms | 32 |
| Complexity | 619.0 |
| SMILES | C1=CC(=CC=C1C(=O)NCCCCNCCCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | CITGVVGNJAJBKW-UHFFFAOYSA-N |
Chemical Property Profile of N(1),N(10)-Bis(4-nitrobenzoyl)spermidine
Property Insights of N(1),N(10)-Bis(4-nitrobenzoyl)spermidine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(1),N(10)-Bis(4-nitrobenzoyl)spermidine. The TPSA of 162.0 Ų indicates high polarity, suggesting N(1),N(10)-Bis(4-nitrobenzoyl)spermidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N(1),N(10)-Bis(4-nitrobenzoyl)spermidine has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N(1),N(10)-Bis(4-nitrobenzoyl)spermidine?
The CAS number of N(1),N(10)-Bis(4-nitrobenzoyl)spermidine is 87581-14-4.
What is the molecular formula of N(1),N(10)-Bis(4-nitrobenzoyl)spermidine?
The molecular formula of N(1),N(10)-Bis(4-nitrobenzoyl)spermidine is C21H25N5O6.
What is the molecular weight of N(1),N(10)-Bis(4-nitrobenzoyl)spermidine?
The molecular weight of N(1),N(10)-Bis(4-nitrobenzoyl)spermidine is 443.18048 g/mol.
Where can I buy N(1),N(10)-Bis(4-nitrobenzoyl)spermidine?
You can request a quote for N(1),N(10)-Bis(4-nitrobenzoyl)spermidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N(1),N(10)-Bis(4-nitrobenzoyl)spermidine?
Yes, CoreyChem provides custom synthesis services for N(1),N(10)-Bis(4-nitrobenzoyl)spermidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.