bleomycin B2
TL;DR: bleomycin B2 (CAS 9060-10-0) is a chemical compound with molecular formula C55H84N20O21S2 and molecular weight 1424.56 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[2-[2-[[6-amino-2-[3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl]-5-methylpyrimidine-4-carbonyl]amino]-3-[[5-[[1-[2-[4-[4-[4-(diaminomethylideneamino)butylcarbamoyl]-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]ethylamino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl]amino]-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] carbamate
Also Known As: bleomycin B2, Phleomycin D2, Dehydrophleomycin D1, Bleomycin B(sub 2), N1-(4-((Aminoiminomethyl)amino)butyl)bleomycinamide
| Molecular Formula | C55H84N20O21S2 |
|---|---|
| Molecular Weight | 1424.56 g/mol |
| LogP | -9.3 |
| Topological Polar Surface Area | 748.0 Ų |
| Hydrogen Bond Donors | 22 |
| Hydrogen Bond Acceptors | 32 |
| Rotatable Bonds | 37 |
| Exact Mass | 1424.5562 |
| Heavy Atoms | 98 |
| Complexity | 2680.0 |
Chemical Identifiers
| CAS Number | 9060-10-0 |
|---|---|
| SMILES | CC1=C(N=C(N=C1N)C(CC(=O)N)NCC(C(=O)N)N)C(=O)NC(C(C2=CN=CN2)OC3C(C(C(C(O3)CO)O)O)OC4C(C(C(C(O4)CO)O)OC(=O)N)O)C(=O)NC(C)C(C(C)C(=O)NC(C(C)O)C(=O)NCCC5=NC(=CS5)C6=NC(=CS6)C(=O)NCCCCN=C(N)N)O |
| InChIKey | NBLHOLNNKJBEDC-UHFFFAOYSA-N |
Product Overview
bleomycin B2 (CAS 9060-10-0), with molecular formula C55H84N20O21S2 and molecular weight 1424.56 g/mol. IUPAC: [2-[2-[2-[[6-amino-2-[3-amino-1-[(2,3-diamino-3-oxopropyl)amino]-3-oxopropyl]-5-methylpyrimidine-4-carbonyl]amino]-3-[[5-[[1-[2-[4-[4-[4-(diaminomethylideneamino)butylcarbamoyl]-1,3-thiazol-2-yl]-1,3-thiazol-2-yl]ethylamino]-3-hydroxy-1-oxobutan-2-yl]amino]-3-hydroxy-4-methyl-5-oxopentan-2-yl]amino]-1-(1H-imidazol-5-yl)-3-oxopropoxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] carbamate.
Chemical Property Profile of bleomycin B2
Property Insights of bleomycin B2
The XLogP value of -9.3 indicates that bleomycin B2 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 748.0 Ų indicates high polarity, suggesting bleomycin B2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, bleomycin B2 has 22 hydrogen bond donor(s) and 32 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of bleomycin B2?
The CAS number of bleomycin B2 is 9060-10-0.
What is the molecular formula of bleomycin B2?
The molecular formula of bleomycin B2 is C55H84N20O21S2.
What is the molecular weight of bleomycin B2?
The molecular weight of bleomycin B2 is 1424.56 g/mol.
Where can I buy bleomycin B2?
You can request a quote for bleomycin B2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for bleomycin B2?
Yes, KEHONG BIO provides custom synthesis services for bleomycin B2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.