 Home > Encyclopedia > 2-[[2-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]-3-[(2-hydroxy-3-methoxyphenyl)methyl]-1,3-diazinan-1-yl]methyl]-6-methoxyphenol

2-[[2-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]-3-[(2-hydroxy-3-methoxyphenyl)methyl]-1,3-diazinan-1-yl]methyl]-6-methoxyphenol

2-[[2-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]-3-[(2-hydroxy-3-methoxyphenyl)methyl]-1,3-diazinan-1-yl]methyl]-6-methoxyphenol structure

CAS No:
5118-18-3
Formula:
C31H39Cl2N3O4
Chemical Name:
2-[[2-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]-3-[(2-hydroxy-3-methoxyphenyl)methyl]-1,3-diazinan-1-yl]methyl]-6-methoxyphenol
Synonyms:
5118-18-3;NSC87905;CHEMBL423220;DTXSID20329083;NSC-87905;ZINC19325427;2-[[2-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]-3-[(2-hydroxy-3-methoxyphenyl)methyl]-1,3-diazinan-1-yl]methyl]-6-methoxyphenol

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2-[[2-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]-3-[(2-hydroxy-3-methoxyphenyl)methyl]-1,3-diazinan-1-yl]methyl]-6-methoxyphenol Basic Attributes

Molecular Weight：

588.6 g/mol

Exact Mass：

587.2317621 g/mol

NSC Number：

87905

DSSTox ID：

DTXSID20329083

Characteristics

PSA：

68.6 Å²

Computed Properties

Molecular Weight:588.6
XLogP3:5.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:12
Exact Mass:587.2317621
Monoisotopic Mass:587.2317621
Topological Polar Surface Area:68.6
Heavy Atom Count:40
Complexity:695
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: e1390; isobutylene; 1-bromo-2-methylpropane; boric acid acid; palm olein; miconazole nitrate

Guide of 2-[[2-[4-[bis(2-chloroethyl)amino]-2-methylphenyl]-3-[(2-hydroxy-3-methoxyphenyl)methyl]-1,3-diazinan-1-yl]methyl]-6-methoxyphenol

Basic Attributes
Characteristics
Computed Properties

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