4-[N-(2,4-DIAMINO-6-PTERIDINYLMETHYL)-N-METHYLAMINO] BENZOIC ACID
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![4-[N-(2,4-DIAMINO-6-PTERIDINYLMETHYL)-N-METHYLAMINO] BENZOIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d8578f54280641e9afffac56629f320b.png "4-[N-(2,4-DIAMINO-6-PTERIDINYLMETHYL)-N-METHYLAMINO] BENZOIC ACID")
4-[N-(2,4-DIAMINO-6-PTERIDINYLMETHYL)-N-METHYLAMINO] BENZOIC ACID
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CAS No:
19741-14-1
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Formula:
C15H15N7O2
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Chemical Name:
4-[N-(2,4-DIAMINO-6-PTERIDINYLMETHYL)-N-METHYLAMINO] BENZOIC ACID
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Synonyms:
2,4-Diamino-N(10)-methylpteroic acid;4-(((2,4-Diamino-6-pteridinyl)methyl)methylamino)benzoic acid;Deoxyaminopteroic acid;N-10-Methyl-4-deoxy-4-aminopteroate;Nsc 131463;DAMPA;4-[N-[(2,4-DiaMinopyriMido[4,5-b]pyrazin-6-yl)Methyl]-N-MethylaMino]benzoic Acid;4-AMino-4-deoxy-10-Methylpteroic Acid
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CAS No:
4-[N-(2,4-DIAMINO-6-PTERIDINYLMETHYL)-N-METHYLAMINO] BENZOIC ACID Basic Attributes
325.33
325.128723
P7OVP484DX
131463
DTXSID20173427
2933990090
Characteristics
144.14000
1.75
1.532
255 °C (dec.)(lit.)
689.3±65.0 °C(Predicted)
370.7±34.3 °C
1.799
5.96E-20mmHg at 25°C
Safety Information
3
43-52/53
36/37
Xi
P201, P202, P261, P264, P270, P271, P280, P281, P301+P310, P302+P352, P304+P340, P305+P351+P338, P308+P313, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501
H301
|Danger|H301 (94.74%): Toxic if swallowed [Danger Acute toxicity, oral]|P201, P202, P261, P264, P270, P271, P280, P281, P301+P310, P302+P352, P304+P340, P305+P351+P338, P308+P313, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 19 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
4-[N-(2,4-DIAMINO-6-PTERIDINYLMETHYL)-N-METHYLAMINO] BENZOIC ACID Use and Manufacturing
DAMPA is a Methotrexate (M260675) analog
Computed Properties
Molecular Weight:325.33
XLogP3:-1.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:325.12872275
Monoisotopic Mass:325.12872275
Topological Polar Surface Area:144
Heavy Atom Count:24
Complexity:444
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Recommended Suppliers of 4-[N-(2,4-DIAMINO-6-PTERIDINYLMETHYL)-N-METHYLAMINO] BENZOIC ACID
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4-[N-(2,4-DIAMINO-6-PTERIDINYLMETHYL)-N-METHYLAMINO] BENZOIC ACID
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