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Home > Encyclopedia > 5-butoxy-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid

5-butoxy-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid

5-butoxy-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid structure

5-butoxy-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid 

structure
  • CAS No:

    66147-31-7

  • Formula:

    C24H30N8O5

  • Chemical Name:

    5-butoxy-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid

  • Synonyms:

    5-monobutyl methotrexate;gamma-MBMTX;NSC 305986;NSC-305986;5-Monobutyl methotrexate;CHEMBL155016;66147-31-7;gamma-Mbmtx;NSC 305986;SCHEMBL14027299;BDBM50028130;NSC305986;NSC-305986;(gamma-n-Bu)2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid 5-butyl ester;L-Glutamic acid, N-(4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl)-, 5-butyl ester

5-butoxy-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid Basic Attributes

510.5 g/mol

510.23391609 g/mol

305986

Characteristics

200 Ų

Drug Information

5-monobutyl methotrexate

Computed Properties

Molecular Weight:510.5
XLogP3:-0.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:13
Exact Mass:510.23391609
Monoisotopic Mass:510.23391609
Topological Polar Surface Area:200
Heavy Atom Count:37
Complexity:765
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 5-butoxy-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-oxopentanoic acid

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