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N-[bis(2-chloroethyl)amino-(naphthalen-2-ylamino)phosphoryl]naphthalen-2-amine

HCID 417688
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Basic information

CAS
27578-76-3
Standard SMILES
O=P(Nc1ccc2ccccc2c1)(Nc1ccc2ccccc2c1)N(CCCl)CCCl
InChIKey
ATSDBLQZZNGFAT-UHFFFAOYSA-N
Molecular formula
C24H24Cl2N3OP
Average molar mass
472.3 g/mol
Monoisotopic mass
471.1034048

Names & identifiers

Preferred name
N-[bis(2-chloroethyl)amino-(naphthalen-2-ylamino)phosphoryl]naphthalen-2-amine
IUPAC
N-[bis(2-chloroethyl)amino-(naphthalen-2-ylamino)phosphoryl]naphthalen-2-amine

Names & synonyms

27578-76-3NSC99023N-[bis(2-chloroethyl)amino-(naphthalen-2-ylamino)phosphoryl]naphthalen-2-amineDTXSID90329136NSC94544NSC-94544NSC-99023N,N-Bis(2-chloroethyl)-N',N''-di(naphthalen-2-yl)phosphoric triamide

Database identifiers

CAS
27578-76-3
PubChem CID
417688
DTXSID
DTXSID90329136

Properties

Computed structural properties

XLogP
7
Topological polar surface area
44.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
31
Formal charge
0
Complexity
563

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