Primary record
Bofumustine
- CAS
- 55102-44-8
- PubChem CID
- 100269
- SMILES
- CC1(O[C@@H]2[C@H](OC([C@@H]2O1)NC(=O)N(CCCl)N=O)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C
- Molecular Formula
- C18H21ClN4O9
- Molecular Weight
- 472.838
- Exact Mass
- 472.0997
- InChI
- InChI=1S/C18H21ClN4O9/c1-18(2)31-13-12(9-29-16(24)10-3-5-11(6-4-10)23(27)28)30-15(14(13)32-18)20-17(25)22(21-26)8-7-19/h3-6,12-15H,7-9H2,1-2H3,(H,20,25)/t12-,13-,14-,15?/m1/s1
- InChIKey
- YASNUXZKZNVXIS-CBNXCZCTSA-N
- LogP
- 1.9284
- TPSA
- 158.9
Names and synonyms
- Bofumustine
- Rfcnu
- Bofumustina
- Bofumustinum
- Bofumustine [INN]
- Bofumustina [Spanish]
- Bofumustinum [INN-Latin]
- Bofumustina [INN-Spanish]
- AC1L2OFJ
- 55102-44-8
- RefChem:1091006
- ICIG 1105
- UNII-6P52D0J76B
- AC1Q1Z3T
- 6P52D0J76B
- SCHEMBL28141
- C18H21ClN4O9
- ICIG-1105
- DTXSID801023914
- orb1700973
- I.C.I.G. 1105
- CHEMBL3989701
- NSC 279194
- NSC-279194
- ICI-G1105
- DTXSID50971579
- DTXCID701399087
- C18-H21-Cl-N4-O9
- AR-1K2890
- CID100269